0 B9R1.69 Brc1c[nH]c(=O)[nH]c1=O 1P003N1Y [0,0,0,0,0,0|1,1,1]=3 1 B9R1.69 Brc1c[nH]c(=O)cc1C 1P01BEN4 [0,0,0,0,0,0|2,1,1]=4 2 B9R1.69 Brc1c[nH]c(=O)cc1Cl 1P00A188 [0,0,0,0,0,0|2,1,1]=4 3 B9R1.69 Brc1c[nH]c(=O)cc1O 1P00G65E [0,0,0,0,0,0|2,1,1]=4 4 B9R1.69 Brc1ccc(c(=O)[nH]1)N 1P0092XJ [0,0,0,0,0,0|4,0,0]=4 5 B9R1.69 Brc1ccc(c(c1)Br)F 1P003G66 [0,0,0,0,0,0|4,0,0]=4 6 B9R1.69 Brc1ccc(c(c1)C)F 1P003MXT [0,0,0,0,0,0|4,0,0]=4 7 B9R1.69 Brc1ccc(c(c1)Cl)F 1P003LCS [0,0,0,0,0,0|4,0,0]=4 8 B9R1.69 Brc1ccc(c(c1)F)F 1P003IXR [0,0,0,0,0,0|4,0,0]=4 9 B9R1.69 Brc1ccc(c(c1)I)F 1P000CK9 [0,0,0,0,0,0|4,0,0]=4 10 B9R1.69 Brc1ccc(c(c1)N)Br 1P00381C [0,0,0,0,0,0|3,1,0]=4 11 B9R1.69 Brc1ccc(c(c1)N)C 1P003MYE [0,0,0,0,0,0|4,0,0]=4 12 B9R1.69 Brc1ccc(c(c1)N)Cl 1P0034O6 [0,0,0,0,0,0|3,1,0]=4 13 B9R1.69 Brc1ccc(c(c1)N)F 1P002YAJ [0,0,0,0,0,0|3,0,0]=3 14 B9R1.69 Brc1ccc(c(c1)N)I 1P00EC4W [0,0,0,0,0,0|3,1,0]=4 15 B9R1.69 Brc1ccc(c(c1)N)N 1P001PY2 [0,0,0,0,0,0|4,0,0]=4 16 B9R1.69 Brc1ccc(c(c1)N)O 1P0033JV [0,0,0,0,0,0|4,0,0]=4 17 B9R1.69 Brc1ccc(c(c1)N)S 1P008LQE [0,0,0,0,0,0|4,0,0]=4 18 B9R1.69 Brc1ccc(c(c1)N)S 1P00H0OS [0,0,0,0,0,0|4,0,0]=4 19 B9R1.69 Brc1ccc(c(c1)O)F 1P003MXQ [0,0,0,0,0,0|4,0,0]=4 20 B9R1.69 Brc1ccc(c(c1)S)F 1P01C12F [0,0,0,0,0,0|4,0,0]=4 21 B9R1.69 Brc1ccc(c(n1)Br)F 1P00C1FR [0,0,0,0,0,0|3,0,1]=4 22 B9R1.69 Brc1ccc(c(n1)C)F 1P00I7U7 [0,0,0,0,0,0|3,0,1]=4 23 B9R1.69 Brc1ccc(c(n1)Cl)F 1P01DEGB [0,0,0,0,0,0|3,0,1]=4 24 B9R1.69 Brc1ccc(c(n1)F)F 1P009K60 [0,0,0,0,0,0|3,0,1]=4 25 B9R1.69 Brc1ccc(c(n1)N)Br 1P006V5M [0,0,0,0,0,0|2,1,1]=4 26 B9R1.69 Brc1ccc(c(n1)N)C 1P003AHY [0,0,0,0,0,0|3,0,1]=4 27 B9R1.69 Brc1ccc(c(n1)N)Cl 1P008YD2 [0,0,0,0,0,0|2,1,1]=4 28 B9R1.69 Brc1ccc(c(n1)N)Cl 1P028R97 [0,0,0,0,0,0|2,1,1]=4 29 B9R1.69 Brc1ccc(c(n1)N)F 1P009YUB [0,0,0,0,0,0|2,0,1]=3 30 B9R1.69 Brc1ccc(c(n1)N)N 1P000Z8P [0,0,0,0,0,0|3,0,1]=4 31 B9R1.69 Brc1ccc(c(n1)N)O 1P006FXZ [0,0,0,0,0,0|3,0,1]=4 32 B9R1.69 Brc1cnc(c(c1)N)F 1P00341Q [0,0,0,0,0,0|4,0,0]=4 33 B9R1.69 Brc1n[nH]c(=O)[nH]c1=O 1P003NK5 [0,0,0,0,0,0|2,1,1]=4 34 B9R1.69 Brc1ncc(c(c1)Br)C 1P005CTF [0,0,0,0,0,0|4,0,0]=4 35 B9R1.69 Brc1ncc(c(c1)Br)Cl 1P00IF4D [0,0,0,0,0,0|3,1,0]=4 36 B9R1.69 Brc1ncc(c(c1)Br)F 1P000OUO [0,0,0,0,0,0|3,0,0]=3 37 B9R1.69 Brc1ncc(c(c1)Br)N 1P00DIFE [0,0,0,0,0,0|4,0,0]=4 38 B9R1.69 Brc1ncc(c(c1)C)Br 1P0033GO [0,0,0,0,0,0|3,1,0]=4 39 B9R1.69 Brc1ncc(c(c1)C)C 1P006L7O [0,0,0,0,0,0|4,0,0]=4 40 B9R1.69 Brc1ncc(c(c1)C)Cl 1P0036QZ [0,0,0,0,0,0|3,1,0]=4 41 B9R1.69 Brc1ncc(c(c1)C)F 1P0036R0 [0,0,0,0,0,0|3,0,0]=3 42 B9R1.69 Brc1ncc(c(c1)C)I 1P003H6L [0,0,0,0,0,0|3,1,0]=4 43 B9R1.69 Brc1ncc(c(c1)C)N 1P001OZW [0,0,0,0,0,0|4,0,0]=4 44 B9R1.69 Brc1ncc(c(c1)C)O 1P009YU8 [0,0,0,0,0,0|4,0,0]=4 45 B9R1.69 Brc1ncc(c(c1)Cl)Br 1P007HFD [0,0,0,0,0,0|3,1,0]=4 46 B9R1.69 Brc1ncc(c(c1)Cl)C 1P007HFE [0,0,0,0,0,0|4,0,0]=4 47 B9R1.69 Brc1ncc(c(c1)Cl)Cl 1P00958D [0,0,0,0,0,0|3,1,0]=4 48 B9R1.69 Brc1ncc(c(c1)Cl)F 1P008ZJU [0,0,0,0,0,0|3,0,0]=3 49 B9R1.69 Brc1ncc(c(c1)Cl)I 1P0012C0 [0,0,0,0,0,0|3,1,0]=4 50 B9R1.69 Brc1ncc(c(c1)F)Br 1P0096WZ [0,0,0,0,0,0|3,1,0]=4 51 B9R1.69 Brc1ncc(c(c1)F)C 1P01KLHG [0,0,0,0,0,0|4,0,0]=4 52 B9R1.69 Brc1ncc(c(c1)F)Cl 1P008Y0W [0,0,0,0,0,0|3,1,0]=4 53 B9R1.69 Brc1ncc(c(c1)F)F 1P00K2XV [0,0,0,0,0,0|3,0,0]=3 54 B9R1.69 Brc1ncc(c(c1)F)I 1P0022PU [0,0,0,0,0,0|3,1,0]=4 55 B9R1.69 Brc1ncc(c(c1)I)Br 1P00954K [0,0,0,0,0,0|3,1,0]=4 56 B9R1.69 Brc1ncc(c(c1)I)C 1P000JSP [0,0,0,0,0,0|4,0,0]=4 57 B9R1.69 Brc1ncc(c(c1)I)Cl 1P009531 [0,0,0,0,0,0|3,1,0]=4 58 B9R1.69 Brc1ncc(c(c1)I)F 1P007E3F [0,0,0,0,0,0|3,0,0]=3 59 B9R1.69 Brc1ncc(c(c1)N)Br 1P00BKFR [0,0,0,0,0,0|2,1,0]=3 60 B9R1.69 Brc1ncc(c(c1)N)C 1P005NQF [0,0,0,0,0,0|3,0,0]=3 61 B9R1.69 Brc1ncc(c(c1)N)Cl 1P00K7VM [0,0,0,0,0,0|2,1,0]=3 62 B9R1.69 Brc1ncc(c(c1)N)F 1P004DSY [0,0,0,0,0,0|2,0,0]=2 63 B9R1.69 Brc1ncc(c(c1)N)I 1P000UFJ [0,0,0,0,0,0|2,1,0]=3 64 B9R1.69 Brc1ncc(c(c1)N)N 1P003AAS [0,0,0,0,0,0|3,0,0]=3 65 B9R1.69 Brc1ncc(c(c1)N)O 1P019GGS [0,0,0,0,0,0|3,0,0]=3 66 B9R1.69 Brc1ncc(c(c1)O)Br 1P0094I6 [0,0,0,0,0,0|3,1,0]=4 67 B9R1.69 Brc1ncc(c(c1)O)C 1P000JS1 [0,0,0,0,0,0|4,0,0]=4 68 B9R1.69 Brc1ncc(c(c1)O)Cl 1P000PRM [0,0,0,0,0,0|3,1,0]=4 69 B9R1.69 Brc1ncc(c(c1)O)F 1P000PS1 [0,0,0,0,0,0|3,0,0]=3 70 B9R1.69 Brc1ncc(c(c1)O)N 1P0281SF [0,0,0,0,0,0|4,0,0]=4 71 B9R1.69 Brc1ncc(c(n1)Br)C 1P00E7U7 [0,0,0,0,0,0|3,0,1]=4 72 B9R1.69 Brc1ncc(c(n1)Br)Cl 1P01FN3I [0,0,0,0,0,0|2,1,1]=4 73 B9R1.69 Brc1ncc(c(n1)Br)F 1P009FLU [0,0,0,0,0,0|2,0,1]=3 74 B9R1.69 Brc1ncc(c(n1)C)Br 1P00AMGN [0,0,0,0,0,0|2,1,1]=4 75 B9R1.69 Brc1ncc(c(n1)C)F 1P0022IO [0,0,0,0,0,0|2,0,1]=3 76 B9R1.69 Brc1ncc(c(n1)Cl)Cl 1P0283CM [0,0,0,0,0,0|2,1,1]=4 77 B9R1.69 Cc1c(Br)cnc(=O)[nH]1 1P0066GF [0,0,0,0,0,0|1,1,0]=2 78 B9R1.69 Cc1c(C)ccc(=O)[nH]1 1P007MBC [0,0,0,0,0,0|3,0,0]=3 79 B9R1.69 Cc1c(C)ncc(=O)[nH]1 1P00ELSX [0,0,0,0,0,0|4,0,0]=4 80 B9R1.69 Cc1c(I)ccc(=O)[nH]1 1P00619X [0,0,0,0,0,0|2,1,0]=3 81 B9R1.69 Cc1c(N)ccc(=O)[nH]1 1P00H0IA [0,0,0,0,0,0|3,0,0]=3 82 B9R1.69 Cc1c[nH]c(=O)[nH]c1=O 1P003V9R [0,0,0,0,0,0|2,0,1]=3 83 B9R1.69 Cc1c[nH]c(=O)[nH]c1=S 1P00CKRB [0,0,0,0,0,0|2,0,1]=3 84 B9R1.69 Cc1c[nH]c(=O)cc1N 1P003A4F [0,0,0,0,0,0|2,0,1]=3 85 B9R1.69 Cc1c[nH]c(=O)nc1N 1P003L6U [0,0,0,0,0,0|1,0,2]=3 86 B9R1.69 Cc1c[nH]c(=O)nc1N 1P00IACF [0,0,0,0,0,0|1,0,2]=3 87 B9R1.69 Cc1c[nH]c(=S)[nH]c1=O 1P003LZ3 [0,0,0,0,0,0|2,1,1]=4 88 B9R1.69 Cc1cc(N)c(=O)[nH]n1 1P007ZUG [0,0,0,0,0,0|4,0,0]=4 89 B9R1.69 Cc1ccc(=N)[nH]c1N 1P00DJKY [0,0,0,0,0,0|3,0,0]=3 90 B9R1.69 Cc1ccc(=O)[nH]c1Cl 1P01SETC [0,0,0,0,0,0|3,0,0]=3 91 B9R1.69 Cc1ccc(=O)[nH]c1N 1P00DK3F [0,0,0,0,0,0|2,0,0]=2 92 B9R1.69 Cc1ccc(=O)[nH]c1N 1P028L3G [0,0,0,0,0,0|2,0,0]=2 93 B9R1.69 Cc1ccc(c(=O)[nH]1)Br 1P00380Z [0,0,0,0,0,0|3,1,0]=4 94 B9R1.69 Cc1ccc(c(c1)Br)F 1P003JIH [0,0,0,0,0,0|4,0,0]=4 95 B9R1.69 Cc1ccc(c(c1)C)F 1P0070HN [0,0,0,0,0,0|4,0,0]=4 96 B9R1.69 Cc1ccc(c(c1)Cl)F 1P001NPP [0,0,0,0,0,0|4,0,0]=4 97 B9R1.69 Cc1ccc(c(c1)F)F 1P002YDV [0,0,0,0,0,0|4,0,0]=4 98 B9R1.69 Cc1ccc(c(c1)I)F 1P003ESJ [0,0,0,0,0,0|4,0,0]=4 99 B9R1.69 Cc1ccc(c(c1)N)Br 1P003H6Q [0,0,0,0,0,0|3,1,0]=4 100 B9R1.69 Cc1ccc(c(c1)N)C 1P003GGB [0,0,0,0,0,0|4,0,0]=4 101 B9R1.69 Cc1ccc(c(c1)N)C 1P00DHID [0,0,0,0,0,0|4,0,0]=4 102 B9R1.69 Cc1ccc(c(c1)N)Cl 1P0033P4 [0,0,0,0,0,0|3,1,0]=4 103 B9R1.69 Cc1ccc(c(c1)N)F 1P0033S2 [0,0,0,0,0,0|3,0,0]=3 104 B9R1.69 Cc1ccc(c(c1)N)I 1P0010F3 [0,0,0,0,0,0|3,1,0]=4 105 B9R1.69 Cc1ccc(c(c1)N)N 1P003IW6 [0,0,0,0,0,0|4,0,0]=4 106 B9R1.69 Cc1ccc(c(c1)N)O 1P003H0G [0,0,0,0,0,0|4,0,0]=4 107 B9R1.69 Cc1ccc(c(c1)N)O 1P003H0H [0,0,0,0,0,0|4,0,0]=4 108 B9R1.69 Cc1ccc(c(c1)N)S 1P00BFWQ [0,0,0,0,0,0|4,0,0]=4 109 B9R1.69 Cc1ccc(c(c1)O)F 1P0036BO [0,0,0,0,0,0|4,0,0]=4 110 B9R1.69 Cc1ccc(c(c1)S)F 1P01BL0T [0,0,0,0,0,0|4,0,0]=4 111 B9R1.69 Cc1ccc(c(n1)Br)F 1P0033LN [0,0,0,0,0,0|3,0,1]=4 112 B9R1.69 Cc1ccc(c(n1)Cl)F 1P0036AW [0,0,0,0,0,0|3,0,1]=4 113 B9R1.69 Cc1ccc(c(n1)F)F 1P00HHDO [0,0,0,0,0,0|3,0,1]=4 114 B9R1.69 Cc1ccc(c(n1)N)Br 1P000T18 [0,0,0,0,0,0|2,1,1]=4 115 B9R1.69 Cc1ccc(c(n1)N)C 1P0036XS [0,0,0,0,0,0|3,0,1]=4 116 B9R1.69 Cc1ccc(c(n1)N)F 1P00HGEG [0,0,0,0,0,0|2,0,1]=3 117 B9R1.69 Cc1ccc(c(n1)N)F 1P027TZX [0,0,0,0,0,0|2,0,1]=3 118 B9R1.69 Cc1ccc(c(n1)N)I 1P003GUD [0,0,0,0,0,0|2,1,1]=4 119 B9R1.69 Cc1ccc(c(n1)N)N 1P003NRN [0,0,0,0,0,0|3,0,1]=4 120 B9R1.69 Cc1ccc(c(n1)N)N 1P00G3UQ [0,0,0,0,0,0|3,0,1]=4 121 B9R1.69 Cc1ccc(c(n1)N)O 1P0029DI [0,0,0,0,0,0|3,0,1]=4 122 B9R1.69 Cc1cnc(c(c1)N)F 1P001ZDA [0,0,0,0,0,0|4,0,0]=4 123 B9R1.69 Cc1n[nH]c(=O)[nH]c1=O 1P00GSV2 [0,0,0,0,0,0|3,0,1]=4 124 B9R1.69 Cc1ncc(c(=O)[nH]1)Br 1P001XXP [0,0,0,0,0,0|2,1,0]=3 125 B9R1.69 Cc1ncc(c(=O)[nH]1)C 1P00313P [0,0,0,0,0,0|3,0,0]=3 126 B9R1.69 Cc1ncc(c(=O)[nH]1)I 1P009540 [0,0,0,0,0,0|2,1,0]=3 127 B9R1.69 Cc1ncc(c(c1)Br)Br 1P00IN65 [0,0,0,0,0,0|3,1,0]=4 128 B9R1.69 Cc1ncc(c(c1)Br)C 1P0038P0 [0,0,0,0,0,0|4,0,0]=4 129 B9R1.69 Cc1ncc(c(c1)Br)Cl 1P009MEJ [0,0,0,0,0,0|3,1,0]=4 130 B9R1.69 Cc1ncc(c(c1)Br)Cl 1P00IM5A [0,0,0,0,0,0|3,1,0]=4 131 B9R1.69 Cc1ncc(c(c1)Br)F 1P003AJU [0,0,0,0,0,0|3,0,0]=3 132 B9R1.69 Cc1ncc(c(c1)Br)N 1P007ELG [0,0,0,0,0,0|4,0,0]=4 133 B9R1.69 Cc1ncc(c(c1)Br)O 1P000OV7 [0,0,0,0,0,0|4,0,0]=4 134 B9R1.69 Cc1ncc(c(c1)C)Br 1P00C4P0 [0,0,0,0,0,0|3,1,0]=4 135 B9R1.69 Cc1ncc(c(c1)C)N 1P000J0K [0,0,0,0,0,0|4,0,0]=4 136 B9R1.69 Cc1ncc(c(c1)Cl)Br 1P000294 [0,0,0,0,0,0|3,1,0]=4 137 B9R1.69 Cc1ncc(c(c1)Cl)C 1P007PEZ [0,0,0,0,0,0|4,0,0]=4 138 B9R1.69 Cc1ncc(c(c1)Cl)F 1P00ACKD [0,0,0,0,0,0|3,0,0]=3 139 B9R1.69 Cc1ncc(c(c1)Cl)N 1P01DL3Y [0,0,0,0,0,0|4,0,0]=4 140 B9R1.69 Cc1ncc(c(c1)I)F 1P02235K [0,0,0,0,0,0|3,0,0]=3 141 B9R1.69 Cc1ncc(c(c1)N)Br 1P007HFV [0,0,0,0,0,0|2,1,0]=3 142 B9R1.69 Cc1ncc(c(c1)N)C 1P00BGL8 [0,0,0,0,0,0|3,0,0]=3 143 B9R1.69 Cc1ncc(c(c1)N)Cl 1P003L6P [0,0,0,0,0,0|2,1,0]=3 144 B9R1.69 Cc1ncc(c(c1)N)F 1P003L6Q [0,0,0,0,0,0|2,0,0]=2 145 B9R1.69 Cc1ncc(c(c1)N)I 1P004RX1 [0,0,0,0,0,0|2,1,0]=3 146 B9R1.69 Cc1ncc(c(c1)N)N 1P004UDT [0,0,0,0,0,0|3,0,0]=3 147 B9R1.69 Cc1ncc(c(c1)N)O 1P028L7I [0,0,0,0,0,0|3,0,0]=3 148 B9R1.69 Cc1ncc(c(c1)O)Br 1P000P9H [0,0,0,0,0,0|3,1,0]=4 149 B9R1.69 Cc1ncc(c(n1)Br)C 1P0287H2 [0,0,0,0,0,0|3,0,1]=4 150 B9R1.69 Cc1ncc(c(n1)C)Br 1P00698R [0,0,0,0,0,0|2,1,1]=4 151 B9R1.69 Cc1ncc(c(n1)C)Cl 1P005VO7 [0,0,0,0,0,0|2,1,1]=4 152 B9R1.69 Cc1ncc(c(n1)C)N 1P003GAV [0,0,0,0,0,0|3,0,1]=4 153 B9R1.69 Cc1ncc(c(n1)C)O 1P00C794 [0,0,0,0,0,0|3,0,1]=4 154 B9R1.69 Cc1ncc(c(n1)Cl)Br 1P004UD4 [0,0,0,0,0,0|2,1,1]=4 155 B9R1.69 Cc1ncc(c(n1)Cl)C 1P0038WW [0,0,0,0,0,0|3,0,1]=4 156 B9R1.69 Cc1ncc(c(n1)Cl)Cl 1P007L7K [0,0,0,0,0,0|2,1,1]=4 157 B9R1.69 Cc1ncc(c(n1)Cl)F 1P0087B4 [0,0,0,0,0,0|2,0,1]=3 158 B9R1.69 Cc1ncc(c(n1)Cl)I 1P009MKU [0,0,0,0,0,0|2,1,1]=4 159 B9R1.69 Cc1ncc(c(n1)Cl)N 1P002DJS [0,0,0,0,0,0|3,0,1]=4 160 B9R1.69 Cc1ncc(c(n1)N)Br 1P00BO3G [0,0,0,0,0,0|1,1,1]=3 161 B9R1.69 Cc1ncc(c(n1)N)C 1P00FCPN [0,0,0,0,0,0|2,0,1]=3 162 B9R1.69 Cc1ncc(c(n1)N)Cl 1P0038C1 [0,0,0,0,0,0|1,1,1]=3 163 B9R1.69 Cc1ncc(c(n1)N)F 1P001H7K [0,0,0,0,0,0|1,0,1]=2 164 B9R1.69 Cc1ncc(c(n1)O)F 1P006UVM [0,0,0,0,0,0|2,0,1]=3 165 B9R1.69 Cc1nnc(c(=O)[nH]1)C 1P00J37K [0,0,0,0,0,0|4,0,0]=4 166 B9R1.69 Cc1nnc(c(c1)N)C 1P01ADGS [0,0,0,0,0,0|4,0,0]=4 167 B9R1.69 Cc1nnc(c(c1)N)Cl 1P01C3S7 [0,0,0,0,0,0|3,1,0]=4 168 B9R1.69 Clc1c(Br)ccc(=O)[nH]1 1P000JVH [0,0,0,0,0,0|2,1,0]=3 169 B9R1.69 Clc1c(Br)ncc(=O)[nH]1 1P003A7T [0,0,0,0,0,0|3,1,0]=4 170 B9R1.69 Clc1c(Cl)ccc(=O)[nH]1 1P002OW4 [0,0,0,0,0,0|2,1,0]=3 171 B9R1.69 Clc1c[nH]c(=O)[nH]c1=O 1P0023QG [0,0,0,0,0,0|1,1,1]=3 172 B9R1.69 Clc1c[nH]c(=O)cc1Cl 1P004TL9 [0,0,0,0,0,0|2,1,1]=4 173 B9R1.69 Clc1ccc(c(=O)[nH]1)Br 1P00GNEE [0,0,0,0,0,0|3,1,0]=4 174 B9R1.69 Clc1ccc(c(=O)[nH]1)C 1P000SBF [0,0,0,0,0,0|4,0,0]=4 175 B9R1.69 Clc1ccc(c(=O)[nH]1)Cl 1P01I7DS [0,0,0,0,0,0|3,1,0]=4 176 B9R1.69 Clc1ccc(c(=O)[nH]1)F 1P00132U [0,0,0,0,0,0|3,0,0]=3 177 B9R1.69 Clc1ccc(c(=S)[nH]1)N 1P01FLO6 [0,0,0,0,0,0|4,0,0]=4 178 B9R1.69 Clc1ccc(c(c1)Br)F 1P002CON [0,0,0,0,0,0|4,0,0]=4 179 B9R1.69 Clc1ccc(c(c1)C)F 1P003N3E [0,0,0,0,0,0|4,0,0]=4 180 B9R1.69 Clc1ccc(c(c1)Cl)F 1P003329 [0,0,0,0,0,0|4,0,0]=4 181 B9R1.69 Clc1ccc(c(c1)F)F 1P003EOJ [0,0,0,0,0,0|4,0,0]=4 182 B9R1.69 Clc1ccc(c(c1)I)F 1P000CK8 [0,0,0,0,0,0|4,0,0]=4 183 B9R1.69 Clc1ccc(c(c1)N)Br 1P003H60 [0,0,0,0,0,0|3,1,0]=4 184 B9R1.69 Clc1ccc(c(c1)N)C 1P003GVR [0,0,0,0,0,0|4,0,0]=4 185 B9R1.69 Clc1ccc(c(c1)N)C 1P005XUA [0,0,0,0,0,0|4,0,0]=4 186 B9R1.69 Clc1ccc(c(c1)N)Cl 1P006BE9 [0,0,0,0,0,0|3,1,0]=4 187 B9R1.69 Clc1ccc(c(c1)N)F 1P002LD0 [0,0,0,0,0,0|3,0,0]=3 188 B9R1.69 Clc1ccc(c(c1)N)I 1P006CBO [0,0,0,0,0,0|3,1,0]=4 189 B9R1.69 Clc1ccc(c(c1)N)N 1P0037CO [0,0,0,0,0,0|4,0,0]=4 190 B9R1.69 Clc1ccc(c(c1)N)O 1P00H7RI [0,0,0,0,0,0|4,0,0]=4 191 B9R1.69 Clc1ccc(c(c1)N)S 1P0002D5 [0,0,0,0,0,0|4,0,0]=4 192 B9R1.69 Clc1ccc(c(c1)O)F 1P007SQI [0,0,0,0,0,0|4,0,0]=4 193 B9R1.69 Clc1ccc(c(c1)S)F 1P01BAC6 [0,0,0,0,0,0|4,0,0]=4 194 B9R1.69 Clc1ccc(c(n1)C)F 1P003HF6 [0,0,0,0,0,0|3,0,1]=4 195 B9R1.69 Clc1ccc(c(n1)Cl)F 1P00I9SY [0,0,0,0,0,0|3,0,1]=4 196 B9R1.69 Clc1ccc(c(n1)I)F 1P009YQZ [0,0,0,0,0,0|3,0,1]=4 197 B9R1.69 Clc1ccc(c(n1)N)Br 1P003GU1 [0,0,0,0,0,0|2,1,1]=4 198 B9R1.69 Clc1ccc(c(n1)N)C 1P00E6FO [0,0,0,0,0,0|3,0,1]=4 199 B9R1.69 Clc1ccc(c(n1)N)C 1P027U9E [0,0,0,0,0,0|3,0,1]=4 200 B9R1.69 Clc1ccc(c(n1)N)Cl 1P007HQF [0,0,0,0,0,0|2,1,1]=4 201 B9R1.69 Clc1ccc(c(n1)N)Cl 1P01FJ5Y [0,0,0,0,0,0|2,1,1]=4 202 B9R1.69 Clc1ccc(c(n1)N)F 1P01A1E3 [0,0,0,0,0,0|2,0,1]=3 203 B9R1.69 Clc1ccc(c(n1)N)I 1P00370E [0,0,0,0,0,0|2,1,1]=4 204 B9R1.69 Clc1ccc(c(n1)N)N 1P0074KN [0,0,0,0,0,0|3,0,1]=4 205 B9R1.69 Clc1ccc(c(n1)N)O 1P00B9QR [0,0,0,0,0,0|3,0,1]=4 206 B9R1.69 Clc1cnc(c(c1)N)F 1P008SBR [0,0,0,0,0,0|4,0,0]=4 207 B9R1.69 Clc1ncc(c(=O)[nH]1)C 1P009K9S [0,0,0,0,0,0|3,0,0]=3 208 B9R1.69 Clc1ncc(c(=O)[nH]1)Cl 1P01BEWZ [0,0,0,0,0,0|2,1,0]=3 209 B9R1.69 Clc1ncc(c(=O)[nH]1)Cl 1P01XAHO [0,0,0,0,0,0|2,1,0]=3 210 B9R1.69 Clc1ncc(c(=O)[nH]1)F 1P001O0F [0,0,0,0,0,0|2,0,0]=2 211 B9R1.69 Clc1ncc(c(=O)[nH]1)I 1P01JUG7 [0,0,0,0,0,0|2,1,0]=3 212 B9R1.69 Clc1ncc(c(c1)Br)Br 1P00I0MZ [0,0,0,0,0,0|3,1,0]=4 213 B9R1.69 Clc1ncc(c(c1)Br)C 1P0036VB [0,0,0,0,0,0|4,0,0]=4 214 B9R1.69 Clc1ncc(c(c1)Br)Cl 1P008UX8 [0,0,0,0,0,0|3,1,0]=4 215 B9R1.69 Clc1ncc(c(c1)Br)F 1P004HS0 [0,0,0,0,0,0|3,0,0]=3 216 B9R1.69 Clc1ncc(c(c1)Br)N 1P020MB7 [0,0,0,0,0,0|4,0,0]=4 217 B9R1.69 Clc1ncc(c(c1)C)Br 1P0033OO [0,0,0,0,0,0|3,1,0]=4 218 B9R1.69 Clc1ncc(c(c1)C)C 1P00CA9N [0,0,0,0,0,0|4,0,0]=4 219 B9R1.69 Clc1ncc(c(c1)C)Cl 1P004AIC [0,0,0,0,0,0|3,1,0]=4 220 B9R1.69 Clc1ncc(c(c1)C)F 1P008C02 [0,0,0,0,0,0|3,0,0]=3 221 B9R1.69 Clc1ncc(c(c1)C)I 1P00382Q [0,0,0,0,0,0|3,1,0]=4 222 B9R1.69 Clc1ncc(c(c1)C)N 1P003JDO [0,0,0,0,0,0|4,0,0]=4 223 B9R1.69 Clc1ncc(c(c1)C)O 1P000JQI [0,0,0,0,0,0|4,0,0]=4 224 B9R1.69 Clc1ncc(c(c1)Cl)Br 1P003MX5 [0,0,0,0,0,0|3,1,0]=4 225 B9R1.69 Clc1ncc(c(c1)Cl)C 1P00E9HW [0,0,0,0,0,0|4,0,0]=4 226 B9R1.69 Clc1ncc(c(c1)Cl)Cl 1P003G2A [0,0,0,0,0,0|3,1,0]=4 227 B9R1.69 Clc1ncc(c(c1)Cl)F 1P002IO2 [0,0,0,0,0,0|3,0,0]=3 228 B9R1.69 Clc1ncc(c(c1)Cl)I 1P0037TO [0,0,0,0,0,0|3,1,0]=4 229 B9R1.69 Clc1ncc(c(c1)Cl)N 1P003MTQ [0,0,0,0,0,0|4,0,0]=4 230 B9R1.69 Clc1ncc(c(c1)Cl)O 1P000PTU [0,0,0,0,0,0|4,0,0]=4 231 B9R1.69 Clc1ncc(c(c1)F)Br 1P009XSM [0,0,0,0,0,0|3,1,0]=4 232 B9R1.69 Clc1ncc(c(c1)F)C 1P000JRR [0,0,0,0,0,0|4,0,0]=4 233 B9R1.69 Clc1ncc(c(c1)F)Cl 1P0015BM [0,0,0,0,0,0|3,1,0]=4 234 B9R1.69 Clc1ncc(c(c1)F)I 1P00137Z [0,0,0,0,0,0|3,1,0]=4 235 B9R1.69 Clc1ncc(c(c1)F)N 1P00HIV6 [0,0,0,0,0,0|4,0,0]=4 236 B9R1.69 Clc1ncc(c(c1)F)O 1P01C4EC [0,0,0,0,0,0|4,0,0]=4 237 B9R1.69 Clc1ncc(c(c1)I)Br 1P00C8QN [0,0,0,0,0,0|3,1,0]=4 238 B9R1.69 Clc1ncc(c(c1)I)C 1P000Q46 [0,0,0,0,0,0|4,0,0]=4 239 B9R1.69 Clc1ncc(c(c1)I)Cl 1P005J3Y [0,0,0,0,0,0|3,1,0]=4 240 B9R1.69 Clc1ncc(c(c1)I)F 1P003HF5 [0,0,0,0,0,0|3,0,0]=3 241 B9R1.69 Clc1ncc(c(c1)I)N 1P00C174 [0,0,0,0,0,0|4,0,0]=4 242 B9R1.69 Clc1ncc(c(c1)I)O 1P008E4Z [0,0,0,0,0,0|4,0,0]=4 243 B9R1.69 Clc1ncc(c(c1)N)Br 1P003L6N [0,0,0,0,0,0|2,1,0]=3 244 B9R1.69 Clc1ncc(c(c1)N)C 1P005NQE [0,0,0,0,0,0|3,0,0]=3 245 B9R1.69 Clc1ncc(c(c1)N)C 1P028TCV [0,0,0,0,0,0|3,0,0]=3 246 B9R1.69 Clc1ncc(c(c1)N)Cl 1P00C7FA [0,0,0,0,0,0|2,1,0]=3 247 B9R1.69 Clc1ncc(c(c1)N)Cl 1P00I3MN [0,0,0,0,0,0|2,1,0]=3 248 B9R1.69 Clc1ncc(c(c1)N)F 1P00419E [0,0,0,0,0,0|2,0,0]=2 249 B9R1.69 Clc1ncc(c(c1)N)I 1P0036Y5 [0,0,0,0,0,0|2,1,0]=3 250 B9R1.69 Clc1ncc(c(c1)N)N 1P005OUX [0,0,0,0,0,0|3,0,0]=3 251 B9R1.69 Clc1ncc(c(c1)N)O 1P0018G6 [0,0,0,0,0,0|3,0,0]=3 252 B9R1.69 Clc1ncc(c(c1)O)Br 1P000PRF [0,0,0,0,0,0|3,1,0]=4 253 B9R1.69 Clc1ncc(c(c1)O)C 1P009X7Y [0,0,0,0,0,0|4,0,0]=4 254 B9R1.69 Clc1ncc(c(c1)O)Cl 1P0033GW [0,0,0,0,0,0|3,1,0]=4 255 B9R1.69 Clc1ncc(c(c1)O)F 1P000PT1 [0,0,0,0,0,0|3,0,0]=3 256 B9R1.69 Clc1ncc(c(c1)O)I 1P000JGR [0,0,0,0,0,0|3,1,0]=4 257 B9R1.69 Clc1ncc(c(c1)O)N 1P0018G5 [0,0,0,0,0,0|4,0,0]=4 258 B9R1.69 Clc1ncc(c(c1)S)Cl 1P028CL4 [0,0,0,0,0,0|3,1,0]=4 259 B9R1.69 Clc1ncc(c(n1)Br)F 1P01XCVN [0,0,0,0,0,0|2,0,1]=3 260 B9R1.69 Clc1ncc(c(n1)Br)N 1P0209J5 [0,0,0,0,0,0|3,0,1]=4 261 B9R1.69 Clc1ncc(c(n1)C)Br 1P00EGBZ [0,0,0,0,0,0|2,1,1]=4 262 B9R1.69 Clc1ncc(c(n1)C)C 1P00C7EL [0,0,0,0,0,0|3,0,1]=4 263 B9R1.69 Clc1ncc(c(n1)C)Cl 1P000IUD [0,0,0,0,0,0|2,1,1]=4 264 B9R1.69 Clc1ncc(c(n1)C)F 1P007N38 [0,0,0,0,0,0|2,0,1]=3 265 B9R1.69 Clc1ncc(c(n1)C)I 1P028N50 [0,0,0,0,0,0|2,1,1]=4 266 B9R1.69 Clc1ncc(c(n1)C)N 1P002DJR [0,0,0,0,0,0|3,0,1]=4 267 B9R1.69 Clc1ncc(c(n1)C)O 1P000MNK [0,0,0,0,0,0|3,0,1]=4 268 B9R1.69 Clc1ncc(c(n1)Cl)Br 1P0034O0 [0,0,0,0,0,0|2,1,1]=4 269 B9R1.69 Clc1ncc(c(n1)Cl)C 1P00266K [0,0,0,0,0,0|3,0,1]=4 270 B9R1.69 Clc1ncc(c(n1)Cl)Cl 1P0033F1 [0,0,0,0,0,0|2,1,1]=4 271 B9R1.69 Clc1ncc(c(n1)Cl)F 1P002YDU [0,0,0,0,0,0|2,0,1]=3 272 B9R1.69 Clc1ncc(c(n1)Cl)I 1P0033FP [0,0,0,0,0,0|2,1,1]=4 273 B9R1.69 Clc1ncc(c(n1)Cl)N 1P003G6U [0,0,0,0,0,0|3,0,1]=4 274 B9R1.69 Clc1ncc(c(n1)Cl)O 1P001BLP [0,0,0,0,0,0|3,0,1]=4 275 B9R1.69 Clc1ncc(c(n1)F)Br 1P021LHJ [0,0,0,0,0,0|2,1,1]=4 276 B9R1.69 Clc1ncc(c(n1)F)Cl 1P0282N4 [0,0,0,0,0,0|2,1,1]=4 277 B9R1.69 Clc1ncc(c(n1)I)C 1P028XVB [0,0,0,0,0,0|3,0,1]=4 278 B9R1.69 Clc1ncc(c(n1)I)Cl 1P01UNXT [0,0,0,0,0,0|2,1,1]=4 279 B9R1.69 Clc1ncc(c(n1)N)Br 1P002AQP [0,0,0,0,0,0|1,1,1]=3 280 B9R1.69 Clc1ncc(c(n1)N)C 1P001J3Z [0,0,0,0,0,0|2,0,1]=3 281 B9R1.69 Clc1ncc(c(n1)N)Cl 1P003L4U [0,0,0,0,0,0|1,1,1]=3 282 B9R1.69 Clc1ncc(c(n1)N)F 1P001O0H [0,0,0,0,0,0|1,0,1]=2 283 B9R1.69 Clc1ncc(c(n1)N)I 1P00E9F7 [0,0,0,0,0,0|1,1,1]=3 284 B9R1.69 Clc1ncc(c(n1)N)N 1P001ED8 [0,0,0,0,0,0|2,0,1]=3 285 B9R1.69 Clc1ncc(c(n1)N)O 1P01DFNQ [0,0,0,0,0,0|2,0,1]=3 286 B9R1.69 Clc1ncc(c(n1)O)Br 1P00G9DG [0,0,0,0,0,0|2,1,1]=4 287 B9R1.69 Clc1nnc(c(c1)N)Cl 1P0038VQ [0,0,0,0,0,0|3,1,0]=4 288 B9R1.69 Clc1nnc(c(c1)N)N 1P01FPCW [0,0,0,0,0,0|4,0,0]=4 289 B9R1.69 Clc1nnc(c(n1)N)Cl 1P01A0VX [0,0,0,0,0,0|2,1,1]=4 290 B9R1.69 Cn1ccc(=O)[nH]c1=O 1P003EZO [0,0,0,0,0,0|4,0,0]=4 291 B9R1.69 Cn1ccc(=O)nc1N 1P002JWG [0,0,0,0,0,0|3,0,1]=4 292 B9R1.69 FC1CNC(=O)NC1=O 1P00FDUV [0,0,0,0,0,0|1,0,3]=4 293 B9R1.69 Fc1c(Br)ccc(=O)[nH]1 1P000JUU [0,0,0,0,0,0|2,1,0]=3 294 B9R1.69 Fc1c[15nH][13c](=O)[15nH]c1=O 1P01CBR6 [0,0,0,0,0,0|1,0,1]=2 295 B9R1.69 Fc1c[nH]c(=O)[nH]c1=O 1P003N8I [0,0,0,0,0,0|1,0,1]=2 296 B9R1.69 Fc1c[nH]c(=O)[nH]c1=S 1P00FD78 [0,0,0,0,0,0|1,0,1]=2 297 B9R1.69 Fc1c[nH]c(=O)cc1Br 1P0034EL [0,0,0,0,0,0|2,0,1]=3 298 B9R1.69 Fc1c[nH]c(=O)cc1I 1P000JSU [0,0,0,0,0,0|2,0,1]=3 299 B9R1.69 Fc1c[nH]c(=O)cc1O 1P00CMFY [0,0,0,0,0,0|2,0,1]=3 300 B9R1.69 Fc1ccc(c(c1)Br)F 1P0076UR [0,0,0,0,0,0|4,0,0]=4 301 B9R1.69 Fc1ccc(c(c1)C)F 1P003GF7 [0,0,0,0,0,0|4,0,0]=4 302 B9R1.69 Fc1ccc(c(c1)Cl)F 1P002OJZ [0,0,0,0,0,0|4,0,0]=4 303 B9R1.69 Fc1ccc(c(c1)F)F 1P003BGE [0,0,0,0,0,0|4,0,0]=4 304 B9R1.69 Fc1ccc(c(c1)I)F 1P003BLZ [0,0,0,0,0,0|4,0,0]=4 305 B9R1.69 Fc1ccc(c(c1)N)Br 1P0001ZW [0,0,0,0,0,0|3,1,0]=4 306 B9R1.69 Fc1ccc(c(c1)N)C 1P003N7P [0,0,0,0,0,0|4,0,0]=4 307 B9R1.69 Fc1ccc(c(c1)N)Cl 1P003HF7 [0,0,0,0,0,0|3,1,0]=4 308 B9R1.69 Fc1ccc(c(c1)N)F 1P003GEW [0,0,0,0,0,0|3,0,0]=3 309 B9R1.69 Fc1ccc(c(c1)N)I 1P00387O [0,0,0,0,0,0|3,1,0]=4 310 B9R1.69 Fc1ccc(c(c1)N)N 1P0038EE [0,0,0,0,0,0|4,0,0]=4 311 B9R1.69 Fc1ccc(c(c1)N)O 1P003GVY [0,0,0,0,0,0|4,0,0]=4 312 B9R1.69 Fc1ccc(c(c1)N)S 1P00811G [0,0,0,0,0,0|4,0,0]=4 313 B9R1.69 Fc1ccc(c(c1)O)F 1P0033GY [0,0,0,0,0,0|4,0,0]=4 314 B9R1.69 Fc1ccc(c(c1)S)F 1P0054EG [0,0,0,0,0,0|4,0,0]=4 315 B9R1.69 Fc1ccc(c(n1)Br)F 1P0018WT [0,0,0,0,0,0|3,0,1]=4 316 B9R1.69 Fc1ccc(c(n1)C)F 1P0280A1 [0,0,0,0,0,0|3,0,1]=4 317 B9R1.69 Fc1ccc(c(n1)F)F 1P0033E2 [0,0,0,0,0,0|3,0,1]=4 318 B9R1.69 Fc1ccc(c(n1)N)Br 1P000KOJ [0,0,0,0,0,0|2,1,1]=4 319 B9R1.69 Fc1ccc(c(n1)N)C 1P020MKO [0,0,0,0,0,0|3,0,1]=4 320 B9R1.69 Fc1ccc(c(n1)N)Cl 1P01B1WF [0,0,0,0,0,0|2,1,1]=4 321 B9R1.69 Fc1ccc(c(n1)N)F 1P00IIO1 [0,0,0,0,0,0|2,0,1]=3 322 B9R1.69 Fc1ccc(c(n1)N)I 1P0290YW [0,0,0,0,0,0|2,1,1]=4 323 B9R1.69 Fc1ccc(c(n1)N)N 1P00EGNA [0,0,0,0,0,0|3,0,1]=4 324 B9R1.69 Fc1ncc(c(c1)Br)C 1P000JST [0,0,0,0,0,0|4,0,0]=4 325 B9R1.69 Fc1ncc(c(c1)Br)Cl 1P01ENN0 [0,0,0,0,0,0|3,1,0]=4 326 B9R1.69 Fc1ncc(c(c1)Br)F 1P009X7O [0,0,0,0,0,0|3,0,0]=3 327 B9R1.69 Fc1ncc(c(c1)Br)I 1P01NLXO [0,0,0,0,0,0|3,1,0]=4 328 B9R1.69 Fc1ncc(c(c1)Br)N 1P01KX76 [0,0,0,0,0,0|4,0,0]=4 329 B9R1.69 Fc1ncc(c(c1)Br)O 1P000JSK [0,0,0,0,0,0|4,0,0]=4 330 B9R1.69 Fc1ncc(c(c1)C)Br 1P003MXO [0,0,0,0,0,0|3,1,0]=4 331 B9R1.69 Fc1ncc(c(c1)C)F 1P021TAC [0,0,0,0,0,0|3,0,0]=3 332 B9R1.69 Fc1ncc(c(c1)C)I 1P000JBZ [0,0,0,0,0,0|3,1,0]=4 333 B9R1.69 Fc1ncc(c(c1)C)N 1P003NOD [0,0,0,0,0,0|4,0,0]=4 334 B9R1.69 Fc1ncc(c(c1)Cl)Br 1P008UXI [0,0,0,0,0,0|3,1,0]=4 335 B9R1.69 Fc1ncc(c(c1)Cl)Cl 1P0223J0 [0,0,0,0,0,0|3,1,0]=4 336 B9R1.69 Fc1ncc(c(c1)Cl)F 1P004XRS [0,0,0,0,0,0|3,0,0]=3 337 B9R1.69 Fc1ncc(c(c1)Cl)I 1P000JBY [0,0,0,0,0,0|3,1,0]=4 338 B9R1.69 Fc1ncc(c(c1)F)Br 1P01KZ25 [0,0,0,0,0,0|3,1,0]=4 339 B9R1.69 Fc1ncc(c(c1)F)C 1P028ZDF [0,0,0,0,0,0|4,0,0]=4 340 B9R1.69 Fc1ncc(c(c1)F)Cl 1P01XCYY [0,0,0,0,0,0|3,1,0]=4 341 B9R1.69 Fc1ncc(c(c1)F)F 1P008ISN [0,0,0,0,0,0|3,0,0]=3 342 B9R1.69 Fc1ncc(c(c1)F)I 1P00G3SH [0,0,0,0,0,0|3,1,0]=4 343 B9R1.69 Fc1ncc(c(c1)F)N 1P001VAP [0,0,0,0,0,0|4,0,0]=4 344 B9R1.69 Fc1ncc(c(c1)F)O 1P00A1YN [0,0,0,0,0,0|4,0,0]=4 345 B9R1.69 Fc1ncc(c(c1)I)Br 1P01KYDT [0,0,0,0,0,0|3,1,0]=4 346 B9R1.69 Fc1ncc(c(c1)I)C 1P003HQ2 [0,0,0,0,0,0|4,0,0]=4 347 B9R1.69 Fc1ncc(c(c1)I)Cl 1P006M71 [0,0,0,0,0,0|3,1,0]=4 348 B9R1.69 Fc1ncc(c(c1)I)F 1P000617 [0,0,0,0,0,0|3,0,0]=3 349 B9R1.69 Fc1ncc(c(c1)I)O 1P00K7SK [0,0,0,0,0,0|4,0,0]=4 350 B9R1.69 Fc1ncc(c(c1)N)Br 1P01FJ5W [0,0,0,0,0,0|2,1,0]=3 351 B9R1.69 Fc1ncc(c(c1)N)C 1P001BAX [0,0,0,0,0,0|3,0,0]=3 352 B9R1.69 Fc1ncc(c(c1)N)Cl 1P01BWH5 [0,0,0,0,0,0|2,1,0]=3 353 B9R1.69 Fc1ncc(c(c1)N)F 1P002IO0 [0,0,0,0,0,0|2,0,0]=2 354 B9R1.69 Fc1ncc(c(c1)O)C 1P00HHDX [0,0,0,0,0,0|4,0,0]=4 355 B9R1.69 Fc1ncc(c(c1)O)Cl 1P024DTD [0,0,0,0,0,0|3,1,0]=4 356 B9R1.69 Fc1ncc(c(c1)O)F 1P021J16 [0,0,0,0,0,0|3,0,0]=3 357 B9R1.69 Fc1ncc(c(n1)F)Br 1P00GX1N [0,0,0,0,0,0|2,1,1]=4 358 B9R1.69 Fc1ncc(c(n1)F)C 1P01B5BQ [0,0,0,0,0,0|3,0,1]=4 359 B9R1.69 Fc1ncc(c(n1)F)Cl 1P002R4P [0,0,0,0,0,0|2,1,1]=4 360 B9R1.69 Fc1ncc(c(n1)F)F 1P0021M5 [0,0,0,0,0,0|2,0,1]=3 361 B9R1.69 Fc1ncc(c(n1)N)Br 1P028U7W [0,0,0,0,0,0|1,1,1]=3 362 B9R1.69 Fc1nnc(c(c1)F)F 1P0285AY [0,0,0,0,0,0|4,0,0]=4 363 B9R1.69 Ic1c[nH]c(=O)[nH]c1=O 1P003NA1 [0,0,0,0,0,0|1,1,1]=3 364 B9R1.69 Ic1ccc(c(c1)Br)F 1P0055SD [0,0,0,0,0,0|4,0,0]=4 365 B9R1.69 Ic1ccc(c(c1)C)F 1P003HQY [0,0,0,0,0,0|4,0,0]=4 366 B9R1.69 Ic1ccc(c(c1)Cl)F 1P001P09 [0,0,0,0,0,0|4,0,0]=4 367 B9R1.69 Ic1ccc(c(c1)F)F 1P003DV1 [0,0,0,0,0,0|4,0,0]=4 368 B9R1.69 Ic1ccc(c(c1)N)Br 1P008UJ0 [0,0,0,0,0,0|3,1,0]=4 369 B9R1.69 Ic1ccc(c(c1)N)C 1P003N9Q [0,0,0,0,0,0|4,0,0]=4 370 B9R1.69 Ic1ccc(c(c1)N)Cl 1P001WXL [0,0,0,0,0,0|3,1,0]=4 371 B9R1.69 Ic1ccc(c(c1)N)F 1P008B0G [0,0,0,0,0,0|3,0,0]=3 372 B9R1.69 Ic1ccc(c(c1)N)I 1P00EUWK [0,0,0,0,0,0|3,1,0]=4 373 B9R1.69 Ic1ccc(c(c1)N)N 1P00I4K3 [0,0,0,0,0,0|4,0,0]=4 374 B9R1.69 Ic1ccc(c(c1)N)O 1P00IKTO [0,0,0,0,0,0|4,0,0]=4 375 B9R1.69 Ic1ccc(c(c1)O)F 1P007623 [0,0,0,0,0,0|4,0,0]=4 376 B9R1.69 Ic1ncc(c(c1)C)Br 1P005UOR [0,0,0,0,0,0|3,1,0]=4 377 B9R1.69 Ic1ncc(c(c1)F)Br 1P009XUE [0,0,0,0,0,0|3,1,0]=4 378 B9R1.69 Ic1ncc(c(n1)C)Br 1P000RXU [0,0,0,0,0,0|2,1,1]=4 379 B9R1.69 Ic1ncc(c(n1)C)Cl 1P000RTJ [0,0,0,0,0,0|2,1,1]=4 380 B9R1.69 NC1C=NC(=O)NC1=O 1P003MVG [0,0,0,0,0,0|2,0,1]=3 381 B9R1.69 Nc1c(F)cnc(=O)[nH]1 1P0028LP [0,0,0,0,0,0|0,0,0]=0 382 B9R1.69 Nc1cc(Cl)n[nH]c1=O 1P01A43A [0,0,0,0,0,0|4,0,0]=4 383 B9R1.69 Nc1ccc(c(c1)Br)F 1P000P2U [0,0,0,0,0,0|4,0,0]=4 384 B9R1.69 Nc1ccc(c(c1)Br)F 1P003JIC [0,0,0,0,0,0|4,0,0]=4 385 B9R1.69 Nc1ccc(c(c1)C)F 1P003HQN [0,0,0,0,0,0|4,0,0]=4 386 B9R1.69 Nc1ccc(c(c1)Cl)F 1P003449 [0,0,0,0,0,0|4,0,0]=4 387 B9R1.69 Nc1ccc(c(c1)F)F 1P0033Z6 [0,0,0,0,0,0|4,0,0]=4 388 B9R1.69 Nc1ccc(c(c1)F)F 1P0202B4 [0,0,0,0,0,0|4,0,0]=4 389 B9R1.69 Nc1ccc(c(c1)I)F 1P00H8SJ [0,0,0,0,0,0|4,0,0]=4 390 B9R1.69 Nc1ccc(c(c1)N)Br 1P00EKEF [0,0,0,0,0,0|3,1,0]=4 391 B9R1.69 Nc1ccc(c(c1)N)Cl 1P003LN2 [0,0,0,0,0,0|3,1,0]=4 392 B9R1.69 Nc1ccc(c(c1)N)Cl 1P0054D4 [0,0,0,0,0,0|3,1,0]=4 393 B9R1.69 Nc1ccc(c(c1)N)F 1P003G61 [0,0,0,0,0,0|3,0,0]=3 394 B9R1.69 Nc1ccc(c(c1)N)N 1P00IBCC [0,0,0,0,0,0|4,0,0]=4 395 B9R1.69 Nc1ccc(c(c1)N)O 1P001356 [0,0,0,0,0,0|4,0,0]=4 396 B9R1.69 Nc1ccc(c(c1)N)O 1P003G62 [0,0,0,0,0,0|4,0,0]=4 397 B9R1.69 Nc1ccc(c(c1)O)F 1P00027G [0,0,0,0,0,0|4,0,0]=4 398 B9R1.69 Nc1ccc(c(c1)O)F 1P028ER8 [0,0,0,0,0,0|4,0,0]=4 399 B9R1.69 Nc1ccc(c(n1)Br)F 1P00A1NN [0,0,0,0,0,0|3,0,1]=4 400 B9R1.69 Nc1ccc(c(n1)C)F 1P003A3H [0,0,0,0,0,0|3,0,1]=4 401 B9R1.69 Nc1ccc(c(n1)Cl)F 1P01K9HS [0,0,0,0,0,0|3,0,1]=4 402 B9R1.69 Nc1ccc(c(n1)N)Br 1P00DDFI [0,0,0,0,0,0|2,1,1]=4 403 B9R1.69 Nc1ccc(c(n1)N)Cl 1P00DJLA [0,0,0,0,0,0|2,1,1]=4 404 B9R1.69 Nc1ccc(c(n1)N)I 1P004Q7Y [0,0,0,0,0,0|2,1,1]=4 405 B9R1.69 Nc1ccc(c(n1)N)N 1P00C2VC [0,0,0,0,0,0|3,0,1]=4 406 B9R1.69 Nc1n[nH]c(=O)[nH]c1=O 1P00756Y [0,0,0,0,0,0|3,0,1]=4 407 B9R1.69 Nc1nc(=O)[nH]cc1Br 1P0034D3 [0,0,0,0,0,0|0,1,2]=3 408 B9R1.69 Nc1nc(=O)[nH]cc1Cl 1P00C1VB [0,0,0,0,0,0|0,1,2]=3 409 B9R1.69 Nc1nc(=O)[nH]cc1I 1P003N9Y [0,0,0,0,0,0|0,1,2]=3 410 B9R1.69 Nc1nc(=O)[nH]cc1N 1P00BU9D [0,0,0,0,0,0|1,0,2]=3 411 B9R1.69 Nc1nc(=O)[nH]cc1N 1P01FJAH [0,0,0,0,0,0|1,0,2]=3 412 B9R1.69 Nc1ncc(c(=O)[nH]1)Br 1P0015Q0 [0,0,0,0,0,0|2,1,0]=3 413 B9R1.69 Nc1ncc(c(=O)[nH]1)Br 1P00EAYR [0,0,0,0,0,0|2,1,0]=3 414 B9R1.69 Nc1ncc(c(=O)[nH]1)C 1P001RVP [0,0,0,0,0,0|3,0,0]=3 415 B9R1.69 Nc1ncc(c(=O)[nH]1)Cl 1P01E83P [0,0,0,0,0,0|2,1,0]=3 416 B9R1.69 Nc1ncc(c(=O)[nH]1)F 1P001YHK [0,0,0,0,0,0|2,0,0]=2 417 B9R1.69 Nc1ncc(c(=O)[nH]1)I 1P00CKRQ [0,0,0,0,0,0|2,1,0]=3 418 B9R1.69 Nc1ncc(c(=O)[nH]1)N 1P003AMC [0,0,0,0,0,0|3,0,0]=3 419 B9R1.69 Nc1ncc(c(c1)Br)Br 1P004Q80 [0,0,0,0,0,0|3,1,0]=4 420 B9R1.69 Nc1ncc(c(c1)Br)C 1P007HFF [0,0,0,0,0,0|4,0,0]=4 421 B9R1.69 Nc1ncc(c(c1)Br)Cl 1P008YCT [0,0,0,0,0,0|3,1,0]=4 422 B9R1.69 Nc1ncc(c(c1)Br)F 1P020M9U [0,0,0,0,0,0|3,0,0]=3 423 B9R1.69 Nc1ncc(c(c1)Br)I 1P0081GV [0,0,0,0,0,0|3,1,0]=4 424 B9R1.69 Nc1ncc(c(c1)Br)N 1P01C5O8 [0,0,0,0,0,0|4,0,0]=4 425 B9R1.69 Nc1ncc(c(c1)C)Br 1P003GX7 [0,0,0,0,0,0|3,1,0]=4 426 B9R1.69 Nc1ncc(c(c1)C)C 1P00EGIV [0,0,0,0,0,0|4,0,0]=4 427 B9R1.69 Nc1ncc(c(c1)C)Cl 1P00I7RS [0,0,0,0,0,0|3,1,0]=4 428 B9R1.69 Nc1ncc(c(c1)C)F 1P007JYO [0,0,0,0,0,0|3,0,0]=3 429 B9R1.69 Nc1ncc(c(c1)C)I 1P003GXS [0,0,0,0,0,0|3,1,0]=4 430 B9R1.69 Nc1ncc(c(c1)C)O 1P0098HF [0,0,0,0,0,0|4,0,0]=4 431 B9R1.69 Nc1ncc(c(c1)Cl)Br 1P005ZOQ [0,0,0,0,0,0|3,1,0]=4 432 B9R1.69 Nc1ncc(c(c1)Cl)C 1P008ZKE [0,0,0,0,0,0|4,0,0]=4 433 B9R1.69 Nc1ncc(c(c1)Cl)Cl 1P002HH9 [0,0,0,0,0,0|3,1,0]=4 434 B9R1.69 Nc1ncc(c(c1)Cl)I 1P005RV0 [0,0,0,0,0,0|3,1,0]=4 435 B9R1.69 Nc1ncc(c(c1)F)Br 1P00IIMV [0,0,0,0,0,0|3,1,0]=4 436 B9R1.69 Nc1ncc(c(c1)F)C 1P01KLA4 [0,0,0,0,0,0|4,0,0]=4 437 B9R1.69 Nc1ncc(c(c1)F)Cl 1P01FPE1 [0,0,0,0,0,0|3,1,0]=4 438 B9R1.69 Nc1ncc(c(c1)F)F 1P009WCW [0,0,0,0,0,0|3,0,0]=3 439 B9R1.69 Nc1ncc(c(c1)F)I 1P00ATGX [0,0,0,0,0,0|3,1,0]=4 440 B9R1.69 Nc1ncc(c(c1)F)O 1P01XC8A [0,0,0,0,0,0|4,0,0]=4 441 B9R1.69 Nc1ncc(c(c1)I)C 1P000JTI [0,0,0,0,0,0|4,0,0]=4 442 B9R1.69 Nc1ncc(c(c1)I)Cl 1P000RHX [0,0,0,0,0,0|3,1,0]=4 443 B9R1.69 Nc1ncc(c(c1)I)F 1P001VN1 [0,0,0,0,0,0|3,0,0]=3 444 B9R1.69 Nc1ncc(c(c1)N)Br 1P000QYJ [0,0,0,0,0,0|2,1,0]=3 445 B9R1.69 Nc1ncc(c(c1)N)F 1P028CPQ [0,0,0,0,0,0|2,0,0]=2 446 B9R1.69 Nc1ncc(c(c1)N)N 1P002N4B [0,0,0,0,0,0|3,0,0]=3 447 B9R1.69 Nc1ncc(c(c1)O)Br 1P01BCNX [0,0,0,0,0,0|3,1,0]=4 448 B9R1.69 Nc1ncc(c(c1)O)Cl 1P019STN [0,0,0,0,0,0|3,1,0]=4 449 B9R1.69 Nc1ncc(c(n1)Br)Br 1P0284U8 [0,0,0,0,0,0|2,1,1]=4 450 B9R1.69 Nc1ncc(c(n1)Br)C 1P000MPX [0,0,0,0,0,0|3,0,1]=4 451 B9R1.69 Nc1ncc(c(n1)C)Br 1P001Z6F [0,0,0,0,0,0|2,1,1]=4 452 B9R1.69 Nc1ncc(c(n1)C)C 1P000J0I [0,0,0,0,0,0|3,0,1]=4 453 B9R1.69 Nc1ncc(c(n1)C)Cl 1P00CMIC [0,0,0,0,0,0|2,1,1]=4 454 B9R1.69 Nc1ncc(c(n1)C)I 1P00BK9G [0,0,0,0,0,0|2,1,1]=4 455 B9R1.69 Nc1ncc(c(n1)Cl)Br 1P0039GU [0,0,0,0,0,0|2,1,1]=4 456 B9R1.69 Nc1ncc(c(n1)Cl)C 1P002DJT [0,0,0,0,0,0|3,0,1]=4 457 B9R1.69 Nc1ncc(c(n1)Cl)Cl 1P003978 [0,0,0,0,0,0|2,1,1]=4 458 B9R1.69 Nc1ncc(c(n1)Cl)F 1P001YHM [0,0,0,0,0,0|2,0,1]=3 459 B9R1.69 Nc1ncc(c(n1)Cl)I 1P00I8AR [0,0,0,0,0,0|2,1,1]=4 460 B9R1.69 Nc1ncc(c(n1)F)Cl 1P0286GN [0,0,0,0,0,0|2,1,1]=4 461 B9R1.69 Nc1ncc(c(n1)N)Br 1P0002D4 [0,0,0,0,0,0|1,1,1]=3 462 B9R1.69 Nc1ncc(c(n1)N)Cl 1P00AT8T [0,0,0,0,0,0|1,1,1]=3 463 B9R1.69 Nc1ncc(c(n1)N)F 1P001O0G [0,0,0,0,0,0|1,0,1]=2 464 B9R1.69 Nc1ncc(c(n1)N)I 1P00HYXG [0,0,0,0,0,0|1,1,1]=3 465 B9R1.69 Nc1ncc(c(n1)N)N 1P00I7I3 [0,0,0,0,0,0|2,0,1]=3 466 B9R1.69 Nc1ncc(c(n1)N)O 1P001GF6 [0,0,0,0,0,0|2,0,1]=3 467 B9R1.69 Nc1nnc(c(=O)[nH]1)C 1P01EBRK [0,0,0,0,0,0|4,0,0]=4 468 B9R1.69 Nn1ccc(=O)[nH]c1=O 1P01AC27 [0,0,0,0,0,0|4,0,0]=4 469 B9R1.69 O=C1C=CC(=O)C(=C1)Br 1P003H2P [0,0,0,0,0,0|4,0,0]=4 470 B9R1.69 O=C1C=CC(=O)C(=C1)C 1P00IABX [0,0,0,0,0,0|4,0,0]=4 471 B9R1.69 O=C1C=CC(=O)C(=C1)Cl 1P003HB5 [0,0,0,0,0,0|4,0,0]=4 472 B9R1.69 O=C1C=CC(=O)C(=C1)I 1P00CZBP [0,0,0,0,0,0|4,0,0]=4 473 B9R1.69 O=C1CCC(=C)C(=O)N1 1P01EMHS [0,0,0,0,0,0|3,0,1]=4 474 B9R1.69 O=C1N=NC(=O)C(=C1)C 1P00629C [0,0,0,0,0,0|4,0,0]=4 475 B9R1.69 O=C1NCC(=O)C(=O)N1 1P003RJ1 [0,0,0,0,0,0|2,0,2]=4 476 B9R1.69 O=c1[nH][nH]c(=S)c(=O)[nH]1 1P002D4G [0,0,0,0,0,0|3,0,1]=4 477 B9R1.69 O=c1occ(c(c1)Cl)Br 1P027X7O [0,0,0,0,0,0|3,1,0]=4 478 B9R1.69 Oc1ccc(c(c1)Br)F 1P00342W [0,0,0,0,0,0|3,0,1]=4 479 B9R1.69 Oc1ccc(c(c1)C)F 1P003LV0 [0,0,0,0,0,0|3,0,1]=4 480 B9R1.69 Oc1ccc(c(c1)Cl)F 1P002S9C [0,0,0,0,0,0|3,0,1]=4 481 B9R1.69 Oc1ccc(c(c1)F)F 1P003IXT [0,0,0,0,0,0|3,0,1]=4 482 B9R1.69 Oc1ccc(c(c1)N)Br 1P000269 [0,0,0,0,0,0|2,1,1]=4 483 B9R1.69 Oc1ccc(c(c1)N)C 1P00I5SA [0,0,0,0,0,0|3,0,1]=4 484 B9R1.69 Oc1ccc(c(c1)N)Cl 1P001SA8 [0,0,0,0,0,0|2,1,1]=4 485 B9R1.69 Oc1ccc(c(c1)N)F 1P003JC8 [0,0,0,0,0,0|2,0,1]=3 486 B9R1.69 Oc1ccc(c(c1)N)N 1P00EKSG [0,0,0,0,0,0|3,0,1]=4 487 B9R1.69 Oc1ccc(c(c1)N)N 1P01DE8U [0,0,0,0,0,0|3,0,1]=4 488 B9R1.69 Oc1ccc(c(c1)N)O 1P01E45U [0,0,0,0,0,0|3,0,1]=4 489 B9R1.69 Oc1ccc(c(c1)O)F 1P0034HK [0,0,0,0,0,0|3,0,1]=4 490 B9R1.69 Oc1ccc(c(n1)I)F 1P028YNW [0,0,0,0,0,0|2,0,2]=4 491 B9R1.69 Oc1ncc(c(c1)Br)C 1P00IN6W [0,0,0,0,0,0|3,0,1]=4 492 B9R1.69 Oc1ncc(c(c1)Br)Cl 1P01FV1O [0,0,0,0,0,0|2,1,1]=4 493 B9R1.69 Oc1ncc(c(c1)C)Br 1P007BY9 [0,0,0,0,0,0|2,1,1]=4 494 B9R1.69 Oc1ncc(c(c1)C)Cl 1P004AIE [0,0,0,0,0,0|2,1,1]=4 495 B9R1.69 Oc1ncc(c(c1)C)I 1P00IINR [0,0,0,0,0,0|2,1,1]=4 496 B9R1.69 Oc1ncc(c(c1)C)N 1P00IIWT [0,0,0,0,0,0|3,0,1]=4 497 B9R1.69 Oc1ncc(c(c1)F)Br 1P01FRHQ [0,0,0,0,0,0|2,1,1]=4 498 B9R1.69 Oc1ncc(c(c1)F)N 1P01BS6M [0,0,0,0,0,0|3,0,1]=4 499 B9R1.69 Oc1ncc(c(c1)I)Cl 1P0099VP [0,0,0,0,0,0|2,1,1]=4 500 B9R1.69 Oc1ncc(c(c1)O)Cl 1P0039GM [0,0,0,0,0,0|2,1,1]=4 501 B9R1.69 Oc1ncc(c(n1)C)C 1P00J2RO [0,0,0,0,0,0|2,0,2]=4 502 B9R1.69 Sc1ccc(c(c1)Br)F 1P00H2Y8 [0,0,0,0,0,0|3,1,0]=4 503 B9R1.69 Sc1ccc(c(c1)Cl)F 1P003JOT [0,0,0,0,0,0|3,1,0]=4 504 B9R1.69 Sc1ccc(c(c1)F)F 1P0033Z8 [0,0,0,0,0,0|3,1,0]=4 505 B9R1.69 Sc1ncc(c(n1)S)C 1P00F3YQ [0,0,0,0,0,0|2,1,1]=4 506 B9R1.69 [O-][n+]1ccc(c(c1)N)F 1P028BT4 [0,0,0,0,0,0|3,0,1]=4 507 B8R1.3 Brc1ccc(=O)[nH]c1 1P01FT0W [1,0,0,0,0,0|1,1,0]=3 508 B8R1.3 Brc1ccc(=O)[nH]n1 1P00DD49 [1,0,0,0,0,0|2,1,0]=4 509 B8R1.3 Brc1ccc(=O)oc1 1P002CSH [1,0,0,0,0,0|2,1,0]=4 510 B8R1.3 Brc1ccc(cn1)Br 1P0033GS [1,0,0,0,0,0|2,1,0]=4 511 B8R1.3 Brc1ccc(cn1)C 1P0033MK [1,0,0,0,0,0|3,0,0]=4 512 B8R1.3 Brc1ccc(cn1)Cl 1P003H65 [1,0,0,0,0,0|2,1,0]=4 513 B8R1.3 Brc1ccc(cn1)F 1P0033MD [1,0,0,0,0,0|2,0,0]=3 514 B8R1.3 Brc1ccc(cn1)I 1P003H6M [1,0,0,0,0,0|2,1,0]=4 515 B8R1.3 Brc1ccc(cn1)N 1P0034ND [1,0,0,0,0,0|3,0,0]=4 516 B8R1.3 Brc1ccc(cn1)O 1P0037PB [1,0,0,0,0,0|3,0,0]=4 517 B8R1.3 Brc1cnc(=O)[nH]c1 1P00522O [1,0,0,0,0,0|0,1,0]=2 518 B8R1.3 Brc1cnc(=O)[nH]c1 1P007R0E [1,0,0,0,0,0|0,1,0]=2 519 B8R1.3 Brc1cnc(=O)[nH]c1 1P028XWC [1,0,0,0,0,0|0,1,0]=2 520 B8R1.3 Brc1cnc(=S)[nH]c1 1P007KX5 [1,0,0,0,0,0|0,2,0]=3 521 B8R1.3 Brc1cnc(nc1)C 1P0034OG [1,0,0,0,0,0|1,1,1]=4 522 B8R1.3 Brc1cnc(nc1)Cl 1P0034O9 [1,0,0,0,0,0|1,1,1]=4 523 B8R1.3 Brc1cnc(nc1)F 1P00E9LT [1,0,0,0,0,0|1,1,1]=4 524 B8R1.3 Brc1cnc(nc1)I 1P002817 [1,0,0,0,0,0|1,1,1]=4 525 B8R1.3 Brc1cnc(nc1)N 1P0033KA [1,0,0,0,0,0|1,1,1]=4 526 B8R1.3 Brc1cnc(nc1)O 1P003MY0 [1,0,0,0,0,0|0,1,2]=4 527 B8R1.3 Brc1ncc(cn1)Br 1P003GDJ [1,0,0,0,0,0|1,1,1]=4 528 B8R1.3 Cc1c[nH]c(=O)cn1 1P002JDA [1,0,0,0,0,0|3,0,0]=4 529 B8R1.3 Cc1ccc(=O)[nH]c1 1P0001YV [1,0,0,0,0,0|2,0,0]=3 530 B8R1.3 Cc1ccc(=O)[nH]n1 1P0014ZS [1,0,0,0,0,0|3,0,0]=4 531 B8R1.3 Cc1ccc(=O)[nH]n1 1P003NRL [1,0,0,0,0,0|3,0,0]=4 532 B8R1.3 Cc1ccc(=O)[nH]n1 1P0068H5 [1,0,0,0,0,0|3,0,0]=4 533 B8R1.3 Cc1ccc(cc1)F 1P003U4A [1,0,0,0,0,0|3,0,0]=4 534 B8R1.3 Cc1ccc(cn1)Br 1P0034OK [1,0,0,0,0,0|2,1,0]=4 535 B8R1.3 Cc1ccc(cn1)C 1P0033HD [1,0,0,0,0,0|3,0,0]=4 536 B8R1.3 Cc1ccc(cn1)Cl 1P003707 [1,0,0,0,0,0|2,1,0]=4 537 B8R1.3 Cc1ccc(cn1)F 1P0038JB [1,0,0,0,0,0|2,0,0]=3 538 B8R1.3 Cc1ccc(cn1)I 1P005Y11 [1,0,0,0,0,0|2,1,0]=4 539 B8R1.3 Cc1ccc(cn1)N 1P003MU7 [1,0,0,0,0,0|3,0,0]=4 540 B8R1.3 Cc1ccc(cn1)O 1P003K0R [1,0,0,0,0,0|3,0,0]=4 541 B8R1.3 Cc1ccc(cn1)[S-] 1P01FLFN [1,0,0,0,0,0|3,0,0]=4 542 B8R1.3 Cc1ccc(nn1)F 1P01BY1P [1,0,0,0,0,0|3,0,0]=4 543 B8R1.3 Cc1cnc(=S)[nH]c1 1P019VBZ [1,0,0,0,0,0|1,1,0]=3 544 B8R1.3 Cc1cnc(nc1)Br 1P001MP5 [1,0,0,0,0,0|2,0,1]=4 545 B8R1.3 Cc1cnc(nc1)Cl 1P003HFX [1,0,0,0,0,0|2,0,1]=4 546 B8R1.3 Cc1cnc(nc1)F 1P00EIC2 [1,0,0,0,0,0|2,0,1]=4 547 B8R1.3 Cc1cnc(nc1)I 1P00AR5N [1,0,0,0,0,0|2,0,1]=4 548 B8R1.3 Cc1cnc(nc1)N 1P00DC10 [1,0,0,0,0,0|2,0,1]=4 549 B8R1.3 Cc1cnc(nc1)O 1P00C7DH [1,0,0,0,0,0|1,0,2]=4 550 B8R1.3 Cc1cnc(nc1)O 1P00J31R [1,0,0,0,0,0|1,0,2]=4 551 B8R1.3 Cc1cnc(nc1)S 1P00C7RF [1,0,0,0,0,0|1,1,1]=4 552 B8R1.3 Clc1c[nH]c(=O)cn1 1P003773 [1,0,0,0,0,0|2,1,0]=4 553 B8R1.3 Clc1ccc(=O)[nH]c1 1P003N3L [1,0,0,0,0,0|1,1,0]=3 554 B8R1.3 Clc1ccc(=O)[nH]n1 1P002F5J [1,0,0,0,0,0|2,1,0]=4 555 B8R1.3 Clc1ccc(=S)[nH]c1 1P003N5K [1,0,0,0,0,0|1,2,0]=4 556 B8R1.3 Clc1ccc(cn1)Br 1P0034O8 [1,0,0,0,0,0|2,1,0]=4 557 B8R1.3 Clc1ccc(cn1)C 1P0039DK [1,0,0,0,0,0|3,0,0]=4 558 B8R1.3 Clc1ccc(cn1)Cl 1P001SM7 [1,0,0,0,0,0|2,1,0]=4 559 B8R1.3 Clc1ccc(cn1)F 1P003HFF [1,0,0,0,0,0|2,0,0]=3 560 B8R1.3 Clc1ccc(cn1)I 1P003HFQ [1,0,0,0,0,0|2,1,0]=4 561 B8R1.3 Clc1ccc(cn1)N 1P0037RK [1,0,0,0,0,0|3,0,0]=4 562 B8R1.3 Clc1ccc(cn1)O 1P0033P0 [1,0,0,0,0,0|3,0,0]=4 563 B8R1.3 Clc1cnc(=O)[nH]c1 1P00DETG [1,0,0,0,0,0|0,1,0]=2 564 B8R1.3 Clc1cnc(nc1)Br 1P000MF4 [1,0,0,0,0,0|1,1,1]=4 565 B8R1.3 Clc1cnc(nc1)C 1P00DGG9 [1,0,0,0,0,0|1,1,1]=4 566 B8R1.3 Clc1cnc(nc1)F 1P00ELBL [1,0,0,0,0,0|1,1,1]=4 567 B8R1.3 Clc1cnc(nc1)I 1P003N3M [1,0,0,0,0,0|1,1,1]=4 568 B8R1.3 Clc1cnc(nc1)N 1P00D8IX [1,0,0,0,0,0|1,1,1]=4 569 B8R1.3 Clc1cnc(nc1)O 1P00I8PR [1,0,0,0,0,0|0,1,2]=4 570 B8R1.3 Clc1ncc(cn1)Cl 1P0033GX [1,0,0,0,0,0|1,1,1]=4 571 B8R1.3 Fc1ccc(=N)[nH]c1 1P003GXR [1,0,0,0,0,0|2,0,0]=3 572 B8R1.3 Fc1ccc(=O)[nH]n1 1P019DIV [1,0,0,0,0,0|2,0,0]=3 573 B8R1.3 Fc1ccc(cc1)Br 1P00336J [1,0,0,0,0,0|3,0,0]=4 574 B8R1.3 Fc1ccc(cc1)Cl 1P007FJJ [1,0,0,0,0,0|3,0,0]=4 575 B8R1.3 Fc1ccc(cc1)F 1P00IA3R [1,0,0,0,0,0|3,0,0]=4 576 B8R1.3 Fc1ccc(cc1)I 1P0034I3 [1,0,0,0,0,0|3,0,0]=4 577 B8R1.3 Fc1ccc(cc1)S 1P0034ID [1,0,0,0,0,0|2,1,0]=4 578 B8R1.3 Fc1ccc(cn1)Br 1P003HQQ [1,0,0,0,0,0|2,1,0]=4 579 B8R1.3 Fc1ccc(cn1)C 1P002OMU [1,0,0,0,0,0|3,0,0]=4 580 B8R1.3 Fc1ccc(cn1)Cl 1P0034PI [1,0,0,0,0,0|2,1,0]=4 581 B8R1.3 Fc1ccc(cn1)F 1P003GF6 [1,0,0,0,0,0|2,0,0]=3 582 B8R1.3 Fc1ccc(cn1)I 1P00APXU [1,0,0,0,0,0|2,1,0]=4 583 B8R1.3 Fc1ccc(cn1)N 1P0024K6 [1,0,0,0,0,0|3,0,0]=4 584 B8R1.3 Fc1ccc(cn1)O 1P0033RZ [1,0,0,0,0,0|3,0,0]=4 585 B8R1.3 Fc1ccc(nn1)Br 1P009I30 [1,0,0,0,0,0|3,0,0]=4 586 B8R1.3 Fc1ccc(nn1)Cl 1P00CJB0 [1,0,0,0,0,0|3,0,0]=4 587 B8R1.3 Fc1ccc(nn1)F 1P007HVY [1,0,0,0,0,0|3,0,0]=4 588 B8R1.3 Fc1ccc(nn1)I 1P001TMP [1,0,0,0,0,0|3,0,0]=4 589 B8R1.3 Fc1cnc(=O)[nH]c1 1P0028LS [1,0,0,0,0,0|0,0,0]=1 590 B8R1.3 Fc1cnc(nc1)Br 1P006SSP [1,0,0,0,0,0|1,0,1]=3 591 B8R1.3 Fc1cnc(nc1)C 1P00DICK [1,0,0,0,0,0|1,0,1]=3 592 B8R1.3 Fc1cnc(nc1)Cl 1P003HFH [1,0,0,0,0,0|1,0,1]=3 593 B8R1.3 Fc1cnc(nc1)I 1P01KHIN [1,0,0,0,0,0|1,0,1]=3 594 B8R1.3 Fc1cnc(nc1)N 1P001YHL [1,0,0,0,0,0|1,0,1]=3 595 B8R1.3 Fc1ncc(cn1)F 1P00ARLR [1,0,0,0,0,0|1,0,1]=3 596 B8R1.3 Fc1ncc(nc1)Br 1P0039TL [1,0,0,0,0,0|3,0,0]=4 597 B8R1.3 Fc1ncc(nc1)Cl 1P01JWK5 [1,0,0,0,0,0|3,0,0]=4 598 B8R1.3 Fc1ncc(nc1)F 1P01BA7S [1,0,0,0,0,0|3,0,0]=4 599 B8R1.3 Ic1ccc(=O)[nH]c1 1P007MAM [1,0,0,0,0,0|1,1,0]=3 600 B8R1.3 Ic1ccc(cn1)Br 1P003806 [1,0,0,0,0,0|2,1,0]=4 601 B8R1.3 Ic1ccc(cn1)C 1P00BFPI [1,0,0,0,0,0|3,0,0]=4 602 B8R1.3 Ic1ccc(cn1)Cl 1P00BD18 [1,0,0,0,0,0|2,1,0]=4 603 B8R1.3 Ic1ccc(cn1)F 1P001RXK [1,0,0,0,0,0|2,0,0]=3 604 B8R1.3 Ic1ccc(cn1)I 1P000CBM [1,0,0,0,0,0|2,1,0]=4 605 B8R1.3 Ic1ccc(cn1)N 1P003MTZ [1,0,0,0,0,0|3,0,0]=4 606 B8R1.3 Ic1ccc(cn1)O 1P000Z9C [1,0,0,0,0,0|3,0,0]=4 607 B8R1.3 Ic1cnc(=O)[nH]c1 1P003HVH [1,0,0,0,0,0|0,1,0]=2 608 B8R1.3 Ic1cnc(nc1)Br 1P00IGOI [1,0,0,0,0,0|1,1,1]=4 609 B8R1.3 Ic1cnc(nc1)C 1P020M10 [1,0,0,0,0,0|1,1,1]=4 610 B8R1.3 Ic1cnc(nc1)Cl 1P0033P2 [1,0,0,0,0,0|1,1,1]=4 611 B8R1.3 Ic1cnc(nc1)F 1P005IU9 [1,0,0,0,0,0|1,1,1]=4 612 B8R1.3 Ic1cnc(nc1)N 1P001K46 [1,0,0,0,0,0|1,1,1]=4 613 B8R1.3 Nc1ccc(=O)[nH]n1 1P003NJN [1,0,0,0,0,0|3,0,0]=4 614 B8R1.3 Nc1ccc(cc1)F 1P0038F1 [1,0,0,0,0,0|3,0,0]=4 615 B8R1.3 Nc1ccc(cc1)F 1P00BG1J [1,0,0,0,0,0|3,0,0]=4 616 B8R1.3 Nc1ccc(cn1)Br 1P0033K9 [1,0,0,0,0,0|2,1,0]=4 617 B8R1.3 Nc1ccc(cn1)C 1P003GY3 [1,0,0,0,0,0|3,0,0]=4 618 B8R1.3 Nc1ccc(cn1)Cl 1P0033KG [1,0,0,0,0,0|2,1,0]=4 619 B8R1.3 Nc1ccc(cn1)I 1P002ACG [1,0,0,0,0,0|2,1,0]=4 620 B8R1.3 Nc1ccc(cn1)N 1P003UJ0 [1,0,0,0,0,0|3,0,0]=4 621 B8R1.3 Nc1ccc(cn1)N 1P00BC5O [1,0,0,0,0,0|3,0,0]=4 622 B8R1.3 Nc1ccc(cn1)O 1P0034SD [1,0,0,0,0,0|3,0,0]=4 623 B8R1.3 Nc1ccc(cn1)O 1P0036WS [1,0,0,0,0,0|3,0,0]=4 624 B8R1.3 Nc1ccc(cn1)O 1P01KZDN [1,0,0,0,0,0|3,0,0]=4 625 B8R1.3 Nc1ccc(nn1)F 1P007CER [1,0,0,0,0,0|3,0,0]=4 626 B8R1.3 Nc1cnc(nc1)Br 1P00ED1R [1,0,0,0,0,0|2,0,1]=4 627 B8R1.3 Nc1cnc(nc1)C 1P003MU8 [1,0,0,0,0,0|2,0,1]=4 628 B8R1.3 Nc1cnc(nc1)Cl 1P0034NG [1,0,0,0,0,0|2,0,1]=4 629 B8R1.3 Nc1cnc(nc1)F 1P00E9OS [1,0,0,0,0,0|2,0,1]=4 630 B8R1.3 Nc1cnc(nc1)I 1P01JPJ7 [1,0,0,0,0,0|2,0,1]=4 631 B8R1.3 Nc1ncc(cn1)N 1P007OGK [1,0,0,0,0,0|2,0,1]=4 632 B8R1.3 Nc1ncc(nc1)F 1P0281L5 [1,0,0,0,0,0|3,0,0]=4 633 B8R1.3 O=C1C=CC(=O)C=C1 1P009L3D [1,0,0,0,0,0|3,0,0]=4 634 B8R1.3 O=c1ccc(=O)[nH][nH]1 1P00035V [1,0,0,0,0,0|3,0,0]=4 635 B8R1.3 Oc1ccc(=O)[nH]c1 1P00DEMJ [1,0,0,0,0,0|2,0,0]=3 636 B8R1.3 Oc1ccc(cc1)F 1P0034I5 [1,0,0,0,0,0|2,0,1]=4 637 B8R1.3 Oc1ccc(cn1)Br 1P0033T3 [1,0,0,0,0,0|1,1,1]=4 638 B8R1.3 Oc1ccc(cn1)C 1P0068BS [1,0,0,0,0,0|2,0,1]=4 639 B8R1.3 Oc1ccc(cn1)F 1P00I9MG [1,0,0,0,0,0|1,0,1]=3 640 B8R1.3 Oc1ccc(cn1)I 1P01FVCZ [1,0,0,0,0,0|1,1,1]=4 641 B8R1.3 Oc1ccc(cn1)N 1P0077NO [1,0,0,0,0,0|2,0,1]=4 642 B8R1.3 Oc1ccc(cn1)N 1P00I734 [1,0,0,0,0,0|2,0,1]=4 643 B8R1.3 Oc1cnc(nc1)Br 1P000LZC [1,0,0,0,0,0|2,0,1]=4 644 B8R1.3 Oc1cnc(nc1)C 1P003N92 [1,0,0,0,0,0|2,0,1]=4 645 B8R1.3 Oc1cnc(nc1)Cl 1P0033P1 [1,0,0,0,0,0|2,0,1]=4 646 B8R1.3 Oc1cnc(nc1)N 1P007ZBH [1,0,0,0,0,0|2,0,1]=4 647 B8R1.3 Sc1ccc(cn1)Br 1P00EGLR [1,0,0,0,0,0|1,2,0]=4 648 B8R1.3 Sc1ccc(cn1)C 1P007TI4 [1,0,0,0,0,0|2,1,0]=4 649 B8R1.3 Sc1ccc(cn1)F 1P01X1P9 [1,0,0,0,0,0|1,1,0]=3 650 B8R1.4 Brc1cc[nH]c(=O)n1 1P00DL8O [1,0,0,0,0,0|1,0,2]=4 651 B8R1.4 Brc1ccnc(c1)Br 1P00IAV6 [1,0,0,0,0,0|3,0,0]=4 652 B8R1.4 Brc1ccnc(c1)C 1P003LDY [1,0,0,0,0,0|3,0,0]=4 653 B8R1.4 Brc1ccnc(c1)C 1P00J1W2 [1,0,0,0,0,0|3,0,0]=4 654 B8R1.4 Brc1ccnc(c1)Cl 1P0034DY [1,0,0,0,0,0|3,0,0]=4 655 B8R1.4 Brc1ccnc(c1)F 1P000Y6T [1,0,0,0,0,0|3,0,0]=4 656 B8R1.4 Brc1ccnc(c1)I 1P0002PZ [1,0,0,0,0,0|3,0,0]=4 657 B8R1.4 Brc1ccnc(c1)N 1P0033JW [1,0,0,0,0,0|3,0,0]=4 658 B8R1.4 Brc1ccnc(c1)O 1P0034E6 [1,0,0,0,0,0|2,0,1]=4 659 B8R1.4 Brc1ccnc(n1)Br 1P00BYDM [1,0,0,0,0,0|2,0,1]=4 660 B8R1.4 Brc1ccnc(n1)C 1P007TD4 [1,0,0,0,0,0|2,0,1]=4 661 B8R1.4 Brc1ccnc(n1)Cl 1P0038U8 [1,0,0,0,0,0|2,0,1]=4 662 B8R1.4 Brc1ccnc(n1)F 1P009MBT [1,0,0,0,0,0|2,0,1]=4 663 B8R1.4 Brc1ccnc(n1)N 1P00C7KA [1,0,0,0,0,0|2,0,1]=4 664 B8R1.4 Brc1ccoc(=O)c1 1P003HU4 [1,0,0,0,0,0|3,0,0]=4 665 B8R1.4 CC1=CN=NC(=O)C1 1P0096LQ [1,0,0,0,0,0|3,0,0]=4 666 B8R1.4 Cc1cccc(=O)[nH]1 1P00I6PQ [1,0,0,0,0,0|2,0,0]=3 667 B8R1.4 Cc1cccc(=O)[nH]1 1P01A5YK [1,0,0,0,0,0|2,0,0]=3 668 B8R1.4 Cc1cccc(c1)N 1P00348Z [1,0,0,0,0,0|3,0,0]=4 669 B8R1.4 Cc1cccc(c1)N 1P003SN3 [1,0,0,0,0,0|3,0,0]=4 670 B8R1.4 Cc1cccc(n1)N 1P0024B7 [1,0,0,0,0,0|2,0,1]=4 671 B8R1.4 Cc1ccnc(=O)[nH]1 1P0033T2 [1,0,0,0,0,0|1,0,0]=2 672 B8R1.4 Cc1ccnc(c1)Br 1P003H5D [1,0,0,0,0,0|3,0,0]=4 673 B8R1.4 Cc1ccnc(c1)C 1P0039FY [1,0,0,0,0,0|3,0,0]=4 674 B8R1.4 Cc1ccnc(c1)Cl 1P003HEL [1,0,0,0,0,0|3,0,0]=4 675 B8R1.4 Cc1ccnc(c1)F 1P003HQB [1,0,0,0,0,0|3,0,0]=4 676 B8R1.4 Cc1ccnc(c1)I 1P00BG0M [1,0,0,0,0,0|3,0,0]=4 677 B8R1.4 Cc1ccnc(c1)N 1P003GW8 [1,0,0,0,0,0|3,0,0]=4 678 B8R1.4 Cc1ccnc(c1)O 1P003HVA [1,0,0,0,0,0|2,0,1]=4 679 B8R1.4 Cc1ccnc(c1)S 1P0076M3 [1,0,0,0,0,0|2,1,0]=4 680 B8R1.4 Cc1ccnc(n1)Br 1P000V75 [1,0,0,0,0,0|2,0,1]=4 681 B8R1.4 Cc1ccnc(n1)C 1P009I3B [1,0,0,0,0,0|2,0,1]=4 682 B8R1.4 Cc1ccnc(n1)Cl 1P000URR [1,0,0,0,0,0|2,0,1]=4 683 B8R1.4 Cc1ccnc(n1)I 1P000P6W [1,0,0,0,0,0|2,0,1]=4 684 B8R1.4 Cc1ccnc(n1)N 1P003GW9 [1,0,0,0,0,0|2,0,1]=4 685 B8R1.4 Cc1ccnc(n1)O 1P006UK2 [1,0,0,0,0,0|1,0,2]=4 686 B8R1.4 Cc1ccnc(n1)S 1P00CI6Y [1,0,0,0,0,0|1,1,1]=4 687 B8R1.4 Cc1cncc(=O)[nH]1 1P002JD9 [1,0,0,0,0,0|3,0,0]=4 688 B8R1.4 Cc1nccc(=N)[nH]1 1P00GATC [1,0,0,0,0,0|1,0,1]=3 689 B8R1.4 Cc1nccc(=O)[nH]1 1P002C6Y [1,0,0,0,0,0|2,0,0]=3 690 B8R1.4 Cc1ncnc(c1)N 1P00I78P [1,0,0,0,0,0|3,0,0]=4 691 B8R1.4 Cc1ncnc(n1)N 1P00CEV9 [1,0,0,0,0,0|2,0,1]=4 692 B8R1.4 Clc1cc[nH]c(=O)n1 1P00G8FV [1,0,0,0,0,0|1,0,2]=4 693 B8R1.4 Clc1cccc(=O)[nH]1 1P001YRQ [1,0,0,0,0,0|2,0,0]=3 694 B8R1.4 Clc1ccnc(c1)Br 1P002LYR [1,0,0,0,0,0|3,0,0]=4 695 B8R1.4 Clc1ccnc(c1)C 1P003LKU [1,0,0,0,0,0|3,0,0]=4 696 B8R1.4 Clc1ccnc(c1)Cl 1P002TQX [1,0,0,0,0,0|3,0,0]=4 697 B8R1.4 Clc1ccnc(c1)F 1P00BZZP [1,0,0,0,0,0|3,0,0]=4 698 B8R1.4 Clc1ccnc(c1)I 1P002LYQ [1,0,0,0,0,0|3,0,0]=4 699 B8R1.4 Clc1ccnc(c1)N 1P002BO7 [1,0,0,0,0,0|3,0,0]=4 700 B8R1.4 Clc1ccnc(c1)O 1P00397T [1,0,0,0,0,0|2,0,1]=4 701 B8R1.4 Clc1ccnc(n1)Br 1P0036RF [1,0,0,0,0,0|2,0,1]=4 702 B8R1.4 Clc1ccnc(n1)C 1P00D9MU [1,0,0,0,0,0|2,0,1]=4 703 B8R1.4 Clc1ccnc(n1)Cl 1P0033FY [1,0,0,0,0,0|2,0,1]=4 704 B8R1.4 Clc1ccnc(n1)F 1P00E2DY [1,0,0,0,0,0|2,0,1]=4 705 B8R1.4 Clc1ccnc(n1)I 1P01FHUV [1,0,0,0,0,0|2,0,1]=4 706 B8R1.4 Clc1ccnc(n1)N 1P00I8AQ [1,0,0,0,0,0|2,0,1]=4 707 B8R1.4 Clc1ccoc(=O)c1 1P01ALG0 [1,0,0,0,0,0|3,0,0]=4 708 B8R1.4 Clc1cncc(=O)[nH]1 1P003HHB [1,0,0,0,0,0|3,0,0]=4 709 B8R1.4 Clc1nccc(=O)[nH]1 1P003A7W [1,0,0,0,0,0|2,0,0]=3 710 B8R1.4 Fc1cc[nH]c(=O)c1 1P005UC3 [1,0,0,0,0,0|2,0,1]=4 711 B8R1.4 Fc1ccnc(c1)Br 1P0033M2 [1,0,0,0,0,0|3,0,0]=4 712 B8R1.4 Fc1ccnc(c1)C 1P0038X5 [1,0,0,0,0,0|3,0,0]=4 713 B8R1.4 Fc1ccnc(c1)Cl 1P003HDV [1,0,0,0,0,0|3,0,0]=4 714 B8R1.4 Fc1ccnc(c1)F 1P00BXW3 [1,0,0,0,0,0|3,0,0]=4 715 B8R1.4 Fc1ccnc(c1)I 1P01XDP3 [1,0,0,0,0,0|3,0,0]=4 716 B8R1.4 Fc1ccnc(c1)N 1P003GVZ [1,0,0,0,0,0|3,0,0]=4 717 B8R1.4 Fc1ccnc(c1)N 1P01B5I0 [1,0,0,0,0,0|3,0,0]=4 718 B8R1.4 Fc1ccnc(n1)Br 1P0097AB [1,0,0,0,0,0|2,0,1]=4 719 B8R1.4 Fc1ccnc(n1)Cl 1P00CJAP [1,0,0,0,0,0|2,0,1]=4 720 B8R1.4 Fc1ccnc(n1)F 1P00BDNZ [1,0,0,0,0,0|2,0,1]=4 721 B8R1.4 Fc1ccnc(n1)N 1P00IKAG [1,0,0,0,0,0|2,0,1]=4 722 B8R1.4 Ic1cc[nH]c(=O)c1 1P004XC8 [1,0,0,0,0,0|2,0,1]=4 723 B8R1.4 Ic1ccnc(c1)Br 1P0002PW [1,0,0,0,0,0|3,0,0]=4 724 B8R1.4 Ic1ccnc(c1)C 1P007PF1 [1,0,0,0,0,0|3,0,0]=4 725 B8R1.4 Ic1ccnc(c1)Cl 1P0033ON [1,0,0,0,0,0|3,0,0]=4 726 B8R1.4 Ic1ccnc(c1)F 1P0033RQ [1,0,0,0,0,0|3,0,0]=4 727 B8R1.4 Ic1ccnc(c1)I 1P0056X9 [1,0,0,0,0,0|3,0,0]=4 728 B8R1.4 Ic1ccnc(c1)N 1P00DGDV [1,0,0,0,0,0|3,0,0]=4 729 B8R1.4 Ic1ccnc(n1)Br 1P00HAJK [1,0,0,0,0,0|2,0,1]=4 730 B8R1.4 Ic1ccnc(n1)C 1P00IDV7 [1,0,0,0,0,0|2,0,1]=4 731 B8R1.4 Ic1ccnc(n1)Cl 1P00I88J [1,0,0,0,0,0|2,0,1]=4 732 B8R1.4 Ic1ccnc(n1)F 1P01DZGE [1,0,0,0,0,0|2,0,1]=4 733 B8R1.4 Ic1ccnc(n1)I 1P002SUH [1,0,0,0,0,0|2,0,1]=4 734 B8R1.4 Ic1ccnc(n1)N 1P005234 [1,0,0,0,0,0|2,0,1]=4 735 B8R1.4 N=c1cc[nH]c(=N)[nH]1 1P00HYTN [1,0,0,0,0,0|1,0,2]=4 736 B8R1.4 Nc1cc(=O)[nH]nc1 1P00436N [1,0,0,0,0,0|2,0,1]=4 737 B8R1.4 Nc1cc[nH]c(=O)c1 1P00I85D [1,0,0,0,0,0|1,0,1]=3 738 B8R1.4 Nc1cccc(=O)[nH]1 1P003GZ7 [1,0,0,0,0,0|1,0,0]=2 739 B8R1.4 Nc1cccc(c1)Br 1P0037HY [1,0,0,0,0,0|3,0,0]=4 740 B8R1.4 Nc1cccc(c1)Cl 1P00344V [1,0,0,0,0,0|3,0,0]=4 741 B8R1.4 Nc1cccc(c1)Cl 1P003JQY [1,0,0,0,0,0|3,0,0]=4 742 B8R1.4 Nc1cccc(c1)F 1P0037S5 [1,0,0,0,0,0|3,0,0]=4 743 B8R1.4 Nc1cccc(c1)I 1P003474 [1,0,0,0,0,0|3,0,0]=4 744 B8R1.4 Nc1cccc(c1)N 1P003DZB [1,0,0,0,0,0|3,0,0]=4 745 B8R1.4 Nc1cccc(c1)N 1P003SN0 [1,0,0,0,0,0|3,0,0]=4 746 B8R1.4 Nc1cccc(c1)N 1P00IN03 [1,0,0,0,0,0|3,0,0]=4 747 B8R1.4 Nc1cccc(c1)O 1P003JEJ [1,0,0,0,0,0|2,0,1]=4 748 B8R1.4 Nc1cccc(c1)O 1P003JEK [1,0,0,0,0,0|2,0,1]=4 749 B8R1.4 Nc1cccc(c1)O 1P00IC9M [1,0,0,0,0,0|2,0,1]=4 750 B8R1.4 Nc1cccc(c1)S 1P002M3F [1,0,0,0,0,0|2,1,0]=4 751 B8R1.4 Nc1cccc(n1)Br 1P002BO6 [1,0,0,0,0,0|2,0,1]=4 752 B8R1.4 Nc1cccc(n1)Cl 1P003GYY [1,0,0,0,0,0|2,0,1]=4 753 B8R1.4 Nc1cccc(n1)F 1P001RT3 [1,0,0,0,0,0|2,0,1]=4 754 B8R1.4 Nc1cccc(n1)I 1P0049TH [1,0,0,0,0,0|2,0,1]=4 755 B8R1.4 Nc1cccc(n1)I 1P0290TM [1,0,0,0,0,0|2,0,1]=4 756 B8R1.4 Nc1cccc(n1)N 1P001G6V [1,0,0,0,0,0|2,0,1]=4 757 B8R1.4 Nc1cccc(n1)N 1P007YE7 [1,0,0,0,0,0|2,0,1]=4 758 B8R1.4 Nc1cccc(n1)O 1P009907 [1,0,0,0,0,0|1,0,2]=4 759 B8R1.4 Nc1cccc(n1)O 1P00EJ34 [1,0,0,0,0,0|1,0,2]=4 760 B8R1.4 Nc1ccnc(=O)[nH]1 1P003551 [1,0,0,0,0,0|0,0,0]=1 761 B8R1.4 Nc1ccnc(c1)Br 1P008PDO [1,0,0,0,0,0|2,0,0]=3 762 B8R1.4 Nc1ccnc(c1)C 1P003L5H [1,0,0,0,0,0|2,0,0]=3 763 B8R1.4 Nc1ccnc(c1)Cl 1P001JSL [1,0,0,0,0,0|2,0,0]=3 764 B8R1.4 Nc1ccnc(c1)F 1P0076RG [1,0,0,0,0,0|2,0,0]=3 765 B8R1.4 Nc1ccnc(c1)I 1P0049B4 [1,0,0,0,0,0|2,0,0]=3 766 B8R1.4 Nc1ccnc(c1)N 1P003UIZ [1,0,0,0,0,0|2,0,0]=3 767 B8R1.4 Nc1ccnc(c1)O 1P00EJV9 [1,0,0,0,0,0|1,0,1]=3 768 B8R1.4 Nc1ccnc(n1)Br 1P000C3K [1,0,0,0,0,0|1,0,1]=3 769 B8R1.4 Nc1ccnc(n1)C 1P005AMT [1,0,0,0,0,0|1,0,1]=3 770 B8R1.4 Nc1ccnc(n1)Cl 1P0034CS [1,0,0,0,0,0|1,0,1]=3 771 B8R1.4 Nc1ccnc(n1)F 1P006R5D [1,0,0,0,0,0|1,0,1]=3 772 B8R1.4 Nc1ccnc(n1)S 1P00BYPV [1,0,0,0,0,0|0,1,1]=3 773 B8R1.4 Nc1cn[nH]c(=O)n1 1P00H052 [1,0,0,0,0,0|1,0,2]=4 774 B8R1.4 Nc1cnnc(c1)Br 1P019GEG [1,0,0,0,0,0|3,0,0]=4 775 B8R1.4 Nc1cnnc(c1)C 1P01C6ZT [1,0,0,0,0,0|3,0,0]=4 776 B8R1.4 Nc1cnnc(c1)Cl 1P002VSC [1,0,0,0,0,0|3,0,0]=4 777 B8R1.4 Nc1cnnc(c1)F 1P028YQV [1,0,0,0,0,0|3,0,0]=4 778 B8R1.4 Nc1cnnc(c1)I 1P028VLK [1,0,0,0,0,0|3,0,0]=4 779 B8R1.4 Nc1cnnc(c1)N 1P028087 [1,0,0,0,0,0|3,0,0]=4 780 B8R1.4 Nc1cnnc(n1)C 1P009T5V [1,0,0,0,0,0|2,0,1]=4 781 B8R1.4 Nc1nc(=O)cc[nH]1 1P003RKF [1,0,0,0,0,0|2,0,1]=4 782 B8R1.4 Nc1nc[nH]c(=O)c1 1P000IZY [1,0,0,0,0,0|2,0,1]=4 783 B8R1.4 Nc1ncnc(=O)[nH]1 1P00IHY0 [1,0,0,0,0,0|1,0,0]=2 784 B8R1.4 Nc1ncnc(c1)Br 1P000HR2 [1,0,0,0,0,0|3,0,0]=4 785 B8R1.4 Nc1ncnc(c1)Cl 1P0034D5 [1,0,0,0,0,0|3,0,0]=4 786 B8R1.4 Nc1ncnc(c1)F 1P00E2DW [1,0,0,0,0,0|3,0,0]=4 787 B8R1.4 Nc1ncnc(c1)I 1P00DJJO [1,0,0,0,0,0|3,0,0]=4 788 B8R1.4 Nc1ncnc(c1)N 1P003KZL [1,0,0,0,0,0|3,0,0]=4 789 B8R1.4 Nc1ncnc(n1)Cl 1P00G5FZ [1,0,0,0,0,0|2,0,1]=4 790 B8R1.4 Nc1ncnc(n1)N 1P00I9IL [1,0,0,0,0,0|2,0,1]=4 791 B8R1.4 Nc1ncnc(n1)S 1P00CMEH [1,0,0,0,0,0|1,1,1]=4 792 B8R1.4 O=C1CC=CC(=O)O1 1P0037LX [1,0,0,0,0,0|3,0,0]=4 793 B8R1.4 O=C1NC=CC(=O)C1 1P01KKXV [1,0,0,0,0,0|2,0,1]=4 794 B8R1.4 O=C1OC=CC(=O)C1 1P0038JQ [1,0,0,0,0,0|3,0,0]=4 795 B8R1.4 O=c1cc[15nH][13c](=O)[15nH]1 1P0023EO [1,0,0,0,0,0|1,0,1]=3 796 B8R1.4 O=c1cc[nH]c(=O)[nH]1 1P00368Z [1,0,0,0,0,0|1,0,1]=3 797 B8R1.4 O=c1cc[nH]c(=S)[nH]1 1P001G6U [1,0,0,0,0,0|1,1,1]=4 798 B8R1.4 O=c1cc[nH]c(=[Se])[nH]1 1P00B386 [1,0,0,0,0,0|1,1,1]=4 799 B8R1.4 O=c1nc[nH]c(=O)[nH]1 1P003750 [1,0,0,0,0,0|2,0,0]=3 800 B8R1.4 O=c1nc[nH]c(c1)Br 1P0038G2 [1,0,0,0,0,0|3,0,0]=4 801 B8R1.4 O=c1nc[nH]c(c1)Cl 1P0038AD [1,0,0,0,0,0|3,0,0]=4 802 B8R1.4 O=c1nc[nH]c(c1)S 1P00IBM4 [1,0,0,0,0,0|3,0,0]=4 803 B8R1.4 Oc1cc[nH]c(=O)c1 1P00IM7P [1,0,0,0,0,0|2,0,1]=4 804 B8R1.4 Oc1cccc(=O)[nH]1 1P0038Q5 [1,0,0,0,0,0|2,0,0]=3 805 B8R1.4 Oc1ccnc(c1)Br 1P0037ZM [1,0,0,0,0,0|3,0,0]=4 806 B8R1.4 Oc1ccnc(c1)C 1P0034IL [1,0,0,0,0,0|3,0,0]=4 807 B8R1.4 Oc1ccnc(c1)Cl 1P001ZK8 [1,0,0,0,0,0|3,0,0]=4 808 B8R1.4 Oc1ccnc(c1)F 1P007PF0 [1,0,0,0,0,0|3,0,0]=4 809 B8R1.4 Oc1ccnc(c1)N 1P003GW0 [1,0,0,0,0,0|3,0,0]=4 810 B8R1.4 Oc1ccnc(c1)N 1P003GW1 [1,0,0,0,0,0|3,0,0]=4 811 B8R1.4 Oc1ccnc(c1)O 1P003GA0 [1,0,0,0,0,0|2,0,1]=4 812 B8R1.4 Oc1ccnc(n1)C 1P0062KT [1,0,0,0,0,0|2,0,1]=4 813 B8R1.4 Oc1ccnc(n1)C 1P01KJLN [1,0,0,0,0,0|2,0,1]=4 814 B8R1.4 Oc1ccnc(n1)N 1P000310 [1,0,0,0,0,0|2,0,1]=4 815 B8R1.4 S=c1cc[nH]c(=O)[nH]1 1P0034M8 [1,0,0,0,0,0|1,0,1]=3 816 B8R1.4 S=c1cc[nH]c(=S)[nH]1 1P002D01 [1,0,0,0,0,0|1,1,1]=4 817 B8R1.4 Sc1cc[nH]c(=O)c1 1P0282DR [1,0,0,0,0,0|2,0,1]=4 818 B8R1.4 [O-]c1ccnc(n1)Cl 1P027ULQ [1,0,0,0,0,0|2,0,1]=4 819 B8R1.4 [S-]c1ccnc(c1)C 1P01FLFM [1,0,0,0,0,0|3,0,0]=4 820 B8R1.5 Brc1cccnc1N 1P006ZHT [1,0,0,0,0,0|1,1,1]=4 821 B8R1.5 Brc1ccncc1I 1P0069LC [1,0,0,0,0,0|2,1,0]=4 822 B8R1.5 Brc1cnc[nH]c1=O 1P002BR3 [1,0,0,0,0,0|1,1,0]=3 823 B8R1.5 Brc1cnc[nH]c1=O 1P006DLU [1,0,0,0,0,0|1,1,0]=3 824 B8R1.5 Brc1cnccc1Br 1P006ZPB [1,0,0,0,0,0|2,1,0]=4 825 B8R1.5 Brc1cnccc1Br 1P028AT2 [1,0,0,0,0,0|2,1,0]=4 826 B8R1.5 Brc1cnccc1I 1P0036Q5 [1,0,0,0,0,0|2,1,0]=4 827 B8R1.5 Brc1cncnc1C 1P007YVW [1,0,0,0,0,0|1,1,1]=4 828 B8R1.5 Brc1cncnc1Cl 1P00172I [1,0,0,0,0,0|1,1,1]=4 829 B8R1.5 Brc1cncnc1Cl 1P0037J3 [1,0,0,0,0,0|1,1,1]=4 830 B8R1.5 Brc1cncnc1F 1P028WZH [1,0,0,0,0,0|1,1,1]=4 831 B8R1.5 Brc1cncnc1N 1P007YVV [1,0,0,0,0,0|0,1,1]=3 832 B8R1.5 Cc1ccccc1F 1P0060O5 [1,0,0,0,0,0|3,0,0]=4 833 B8R1.5 Cc1ccccc1N 1P003TYU [1,0,0,0,0,0|3,0,0]=4 834 B8R1.5 Cc1cccnc1N 1P003GUI [1,0,0,0,0,0|2,0,1]=4 835 B8R1.5 Cc1ccncc1Br 1P00342Z [1,0,0,0,0,0|2,1,0]=4 836 B8R1.5 Cc1ccncc1Cl 1P00344K [1,0,0,0,0,0|2,1,0]=4 837 B8R1.5 Cc1ccncc1F 1P00I8AH [1,0,0,0,0,0|2,0,0]=3 838 B8R1.5 Cc1ccncc1I 1P00CHQ4 [1,0,0,0,0,0|2,1,0]=4 839 B8R1.5 Cc1ccncc1N 1P00341P [1,0,0,0,0,0|3,0,0]=4 840 B8R1.5 Cc1ccncc1O 1P003K0L [1,0,0,0,0,0|3,0,0]=4 841 B8R1.5 Cc1cnccc1Br 1P0034EI [1,0,0,0,0,0|3,0,0]=4 842 B8R1.5 Cc1cnccc1Br 1P00HF33 [1,0,0,0,0,0|3,0,0]=4 843 B8R1.5 Cc1cnccc1C 1P00E9VT [1,0,0,0,0,0|3,0,0]=4 844 B8R1.5 Cc1cnccc1Cl 1P001Y9Y [1,0,0,0,0,0|3,0,0]=4 845 B8R1.5 Cc1cnccc1Cl 1P003LLP [1,0,0,0,0,0|3,0,0]=4 846 B8R1.5 Cc1cnccc1F 1P002VYO [1,0,0,0,0,0|3,0,0]=4 847 B8R1.5 Cc1cnccc1I 1P01ELGO [1,0,0,0,0,0|3,0,0]=4 848 B8R1.5 Cc1cnccc1N 1P002CC8 [1,0,0,0,0,0|2,0,0]=3 849 B8R1.5 Cc1cnccc1O 1P00347V [1,0,0,0,0,0|3,0,0]=4 850 B8R1.5 Cc1cncnc1Br 1P000P75 [1,0,0,0,0,0|2,0,1]=4 851 B8R1.5 Cc1cncnc1Cl 1P00DB4W [1,0,0,0,0,0|2,0,1]=4 852 B8R1.5 Cc1cncnc1N 1P0037ZT [1,0,0,0,0,0|1,0,1]=3 853 B8R1.5 Cc1cncnc1O 1P007URT [1,0,0,0,0,0|2,0,1]=4 854 B8R1.5 Cc1cnncc1N 1P00H51F [1,0,0,0,0,0|3,0,0]=4 855 B8R1.5 Cc1cnncc1N 1P01KY6Y [1,0,0,0,0,0|3,0,0]=4 856 B8R1.5 Clc1cccnc1N 1P003GU5 [1,0,0,0,0,0|1,1,1]=4 857 B8R1.5 Clc1ccncc1Br 1P00238J [1,0,0,0,0,0|2,1,0]=4 858 B8R1.5 Clc1ccncc1Br 1P0038DU [1,0,0,0,0,0|2,1,0]=4 859 B8R1.5 Clc1ccncc1I 1P003LLL [1,0,0,0,0,0|2,1,0]=4 860 B8R1.5 Clc1ccncc1I 1P01DMJT [1,0,0,0,0,0|2,1,0]=4 861 B8R1.5 Clc1cnc[nH]c1=S 1P0288KI [1,0,0,0,0,0|1,1,0]=3 862 B8R1.5 Clc1cnccc1Br 1P005Z31 [1,0,0,0,0,0|2,1,0]=4 863 B8R1.5 Clc1cnccc1Cl 1P00DECZ [1,0,0,0,0,0|2,1,0]=4 864 B8R1.5 Clc1cnccc1I 1P008NQC [1,0,0,0,0,0|2,1,0]=4 865 B8R1.5 Clc1cncnc1Br 1P000SCL [1,0,0,0,0,0|1,1,1]=4 866 B8R1.5 Clc1cncnc1C 1P00DF1Z [1,0,0,0,0,0|1,1,1]=4 867 B8R1.5 Clc1cncnc1N 1P0004JZ [1,0,0,0,0,0|0,1,1]=3 868 B8R1.5 Clc1cncnc1O 1P00DL92 [1,0,0,0,0,0|1,1,1]=4 869 B8R1.5 Clc1ncncc1Cl 1P0037HT [1,0,0,0,0,0|1,1,1]=4 870 B8R1.5 Fc1ccccc1Br 1P0033N6 [1,0,0,0,0,0|3,0,0]=4 871 B8R1.5 Fc1ccccc1Cl 1P003A36 [1,0,0,0,0,0|3,0,0]=4 872 B8R1.5 Fc1ccccc1I 1P003ESK [1,0,0,0,0,0|3,0,0]=4 873 B8R1.5 Fc1ccccc1S 1P0033SM [1,0,0,0,0,0|3,0,0]=4 874 B8R1.5 Fc1cccnc1Br 1P0033LP [1,0,0,0,0,0|2,0,1]=4 875 B8R1.5 Fc1cccnc1C 1P001R2T [1,0,0,0,0,0|2,0,1]=4 876 B8R1.5 Fc1cccnc1Cl 1P003HC6 [1,0,0,0,0,0|2,0,1]=4 877 B8R1.5 Fc1cccnc1I 1P001E78 [1,0,0,0,0,0|2,0,1]=4 878 B8R1.5 Fc1cccnc1N 1P003GU9 [1,0,0,0,0,0|1,0,1]=3 879 B8R1.5 Fc1cccnc1O 1P003JVS [1,0,0,0,0,0|2,0,1]=4 880 B8R1.5 Fc1ccncc1Br 1P000DU4 [1,0,0,0,0,0|2,1,0]=4 881 B8R1.5 Fc1ccncc1Cl 1P00496H [1,0,0,0,0,0|2,1,0]=4 882 B8R1.5 Fc1cnc[nH]c1=O 1P00377B [1,0,0,0,0,0|1,0,0]=2 883 B8R1.5 Fc1cnccc1Br 1P000HQI [1,0,0,0,0,0|2,0,0]=3 884 B8R1.5 Fc1cnccc1Br 1P00387U [1,0,0,0,0,0|2,0,0]=3 885 B8R1.5 Fc1cnccc1Cl 1P000IW9 [1,0,0,0,0,0|2,0,0]=3 886 B8R1.5 Fc1cnccc1Cl 1P0034G5 [1,0,0,0,0,0|2,0,0]=3 887 B8R1.5 Fc1cnccc1F 1P0038VF [1,0,0,0,0,0|2,0,0]=3 888 B8R1.5 Fc1cnccc1I 1P00345U [1,0,0,0,0,0|2,0,0]=3 889 B8R1.5 Fc1cnccc1S 1P01DYY6 [1,0,0,0,0,0|2,0,0]=3 890 B8R1.5 Fc1cncnc1Br 1P000285 [1,0,0,0,0,0|1,0,1]=3 891 B8R1.5 Fc1cncnc1Cl 1P00BYYI [1,0,0,0,0,0|1,0,1]=3 892 B8R1.5 Fc1cncnc1I 1P0285JN [1,0,0,0,0,0|1,0,1]=3 893 B8R1.5 Fc1cncnc1N 1P00370Z [1,0,0,0,0,0|0,0,1]=2 894 B8R1.5 Fc1ncccc1F 1P001NQA [1,0,0,0,0,0|2,0,1]=4 895 B8R1.5 Fc1ncncc1F 1P0292X9 [1,0,0,0,0,0|1,0,1]=3 896 B8R1.5 Ic1cccnc1N 1P003K2I [1,0,0,0,0,0|1,1,1]=4 897 B8R1.5 Ic1cnccc1I 1P01KLJE [1,0,0,0,0,0|2,1,0]=4 898 B8R1.5 Ic1cncnc1Br 1P001MPL [1,0,0,0,0,0|1,1,1]=4 899 B8R1.5 Ic1cncnc1C 1P00H1F1 [1,0,0,0,0,0|1,1,1]=4 900 B8R1.5 Ic1cncnc1Cl 1P0037F7 [1,0,0,0,0,0|1,1,1]=4 901 B8R1.5 Ic1cncnc1F 1P027XFL [1,0,0,0,0,0|1,1,1]=4 902 B8R1.5 Ic1cncnc1N 1P006NO5 [1,0,0,0,0,0|0,1,1]=3 903 B8R1.5 Ic1cncnc1O 1P00DEV9 [1,0,0,0,0,0|1,1,1]=4 904 B8R1.5 Nc1ccccc1Br 1P0033MQ [1,0,0,0,0,0|2,1,0]=4 905 B8R1.5 Nc1ccccc1Br 1P003H80 [1,0,0,0,0,0|2,1,0]=4 906 B8R1.5 Nc1ccccc1Cl 1P0033PQ [1,0,0,0,0,0|2,1,0]=4 907 B8R1.5 Nc1ccccc1Cl 1P003HI4 [1,0,0,0,0,0|2,1,0]=4 908 B8R1.5 Nc1ccccc1F 1P0033SA [1,0,0,0,0,0|2,0,0]=3 909 B8R1.5 Nc1ccccc1F 1P00DC77 [1,0,0,0,0,0|2,0,0]=3 910 B8R1.5 Nc1ccccc1I 1P003HXD [1,0,0,0,0,0|2,1,0]=4 911 B8R1.5 Nc1ccccc1N 1P0035WA [1,0,0,0,0,0|3,0,0]=4 912 B8R1.5 Nc1ccccc1N 1P003TY8 [1,0,0,0,0,0|3,0,0]=4 913 B8R1.5 Nc1ccccc1O 1P00FAMG [1,0,0,0,0,0|3,0,0]=4 914 B8R1.5 Nc1ccccc1O 1P00I9LJ [1,0,0,0,0,0|3,0,0]=4 915 B8R1.5 Nc1cccnc1F 1P001RT2 [1,0,0,0,0,0|3,0,0]=4 916 B8R1.5 Nc1ccn[nH]c1=O 1P00DGSD [1,0,0,0,0,0|3,0,0]=4 917 B8R1.5 Nc1ccncc1Br 1P0034CX [1,0,0,0,0,0|1,1,0]=3 918 B8R1.5 Nc1ccncc1Cl 1P002BO8 [1,0,0,0,0,0|1,1,0]=3 919 B8R1.5 Nc1ccncc1F 1P003L66 [1,0,0,0,0,0|1,0,0]=2 920 B8R1.5 Nc1ccncc1I 1P003L6A [1,0,0,0,0,0|1,1,0]=3 921 B8R1.5 Nc1ccncc1O 1P003AUC [1,0,0,0,0,0|2,0,0]=3 922 B8R1.5 Nc1ccncc1O 1P003L68 [1,0,0,0,0,0|2,0,0]=3 923 B8R1.5 Nc1ccncc1O 1P008WTQ [1,0,0,0,0,0|2,0,0]=3 924 B8R1.5 Nc1ccnnc1C 1P01A5Q6 [1,0,0,0,0,0|3,0,0]=4 925 B8R1.5 Nc1ccnnc1Cl 1P00DIBS [1,0,0,0,0,0|2,1,0]=4 926 B8R1.5 Nc1cnc[nH]c1=O 1P0038XW [1,0,0,0,0,0|2,0,0]=3 927 B8R1.5 Nc1cnccc1Br 1P00I532 [1,0,0,0,0,0|3,0,0]=4 928 B8R1.5 Nc1cnccc1Cl 1P002ACF [1,0,0,0,0,0|3,0,0]=4 929 B8R1.5 Nc1cnccc1F 1P01BBYC [1,0,0,0,0,0|3,0,0]=4 930 B8R1.5 Nc1cnccc1I 1P0038HQ [1,0,0,0,0,0|3,0,0]=4 931 B8R1.5 Nc1cnccc1N 1P003IW5 [1,0,0,0,0,0|2,0,0]=3 932 B8R1.5 Nc1cnccc1O 1P00954L [1,0,0,0,0,0|3,0,0]=4 933 B8R1.5 Nc1cnccc1S 1P00H1LW [1,0,0,0,0,0|3,0,0]=4 934 B8R1.5 Nc1cncnc1Br 1P0053HJ [1,0,0,0,0,0|2,0,1]=4 935 B8R1.5 Nc1cncnc1C 1P00C0LQ [1,0,0,0,0,0|2,0,1]=4 936 B8R1.5 Nc1cncnc1Cl 1P00D9C5 [1,0,0,0,0,0|2,0,1]=4 937 B8R1.5 Nc1cncnc1I 1P00H1KQ [1,0,0,0,0,0|2,0,1]=4 938 B8R1.5 Nc1cncnc1O 1P008WYI [1,0,0,0,0,0|2,0,1]=4 939 B8R1.5 Nc1cnncc1Br 1P00DICJ [1,0,0,0,0,0|2,1,0]=4 940 B8R1.5 Nc1cnncc1Cl 1P0037TD [1,0,0,0,0,0|2,1,0]=4 941 B8R1.5 Nc1cnncc1N 1P002WJ5 [1,0,0,0,0,0|3,0,0]=4 942 B8R1.5 Nc1ncccc1N 1P00396H [1,0,0,0,0,0|2,0,1]=4 943 B8R1.5 Nc1nccnc1F 1P019DIR [1,0,0,0,0,0|2,0,1]=4 944 B8R1.5 Nc1ncncc1N 1P001405 [1,0,0,0,0,0|1,0,1]=3 945 B8R1.5 Nc1ncncc1N 1P01A7IH [1,0,0,0,0,0|1,0,1]=3 946 B8R1.5 Nc1ncncc1N 1P01FYMI [1,0,0,0,0,0|1,0,1]=3 947 B8R1.5 O=c1[nH]cccc1C 1P0001Z2 [1,0,0,0,0,0|3,0,0]=4 948 B8R1.5 O=c1[nH]cccc1I 1P01FPD4 [1,0,0,0,0,0|2,1,0]=4 949 B8R1.5 O=c1[nH]cccc1N 1P003AA1 [1,0,0,0,0,0|3,0,0]=4 950 B8R1.5 Oc1ccccc1F 1P003HSS [1,0,0,0,0,0|3,0,0]=4 951 B8R1.5 Oc1cccnc1N 1P003GUC [1,0,0,0,0,0|2,0,1]=4 952 B8R1.5 Oc1ccncc1Br 1P003JIN [1,0,0,0,0,0|2,1,0]=4 953 B8R1.5 Oc1ccncc1Cl 1P003JOW [1,0,0,0,0,0|2,1,0]=4 954 B8R1.5 Oc1ccncc1F 1P0036K6 [1,0,0,0,0,0|2,0,0]=3 955 B8R1.5 Oc1ccncc1I 1P003K2J [1,0,0,0,0,0|2,1,0]=4 956 B8R1.5 Oc1cnc[nH]c1=N 1P00DIFU [1,0,0,0,0,0|1,0,1]=3 957 B8R1.5 Oc1cnc[nH]c1=O 1P001QMI [1,0,0,0,0,0|2,0,0]=3 958 B8R1.5 Oc1cnccc1Br 1P001SX1 [1,0,0,0,0,0|3,0,0]=4 959 B8R1.5 Oc1cnccc1Cl 1P0034G7 [1,0,0,0,0,0|3,0,0]=4 960 B8R1.5 Oc1cnccc1I 1P002H4K [1,0,0,0,0,0|3,0,0]=4 961 B8R1.5 Oc1cnccc1O 1P00063S [1,0,0,0,0,0|3,0,0]=4 962 B8R1.5 Oc1cncnc1C 1P0004JY [1,0,0,0,0,0|2,0,1]=4 963 B8R1.5 S=c1[nH]cccc1C 1P0076M2 [1,0,0,0,0,0|3,0,0]=4 964 B8R1.5 S=c1[nH]cccc1F 1P01BDFB [1,0,0,0,0,0|2,0,0]=3 965 B8R1.5 S=c1[nH]cccc1N 1P00C6TQ [1,0,0,0,0,0|3,0,0]=4 966 B8R1.5 S=c1[nH]cccc1O 1P002MAZ [1,0,0,0,0,0|3,0,0]=4 967 B8R1.5 Sc1ccncc1Br 1P00G47E [1,0,0,0,0,0|2,1,0]=4 968 B8R1.5 Sc1ccncc1Cl 1P01BIHD [1,0,0,0,0,0|2,1,0]=4 969 B10R1.22 Brc1cc(C)c(c(c1)N)F 1P009XJW [0,1,0,0,0,0|3,0,0]=4 970 B10R1.22 Brc1cc(N)c(c(c1)F)F 1P009XJQ [0,1,0,0,0,0|3,0,0]=4 971 B10R1.22 Brc1cc(N)c(c(c1)I)F 1P028D6X [0,1,0,0,0,0|3,0,0]=4 972 B10R1.22 Brc1cc(N)c(c(n1)Br)Br 1P01K0C6 [0,1,0,0,0,0|2,1,0]=4 973 B10R1.22 Brc1cc(N)c(c(n1)Br)Cl 1P01K0WQ [0,1,0,0,0,0|2,1,0]=4 974 B10R1.22 Brc1cc(N)c(c(n1)Cl)N 1P00AR8X [0,1,0,0,0,0|3,0,0]=4 975 B10R1.22 Cc1[nH]c(=O)[nH]c(=O)c1Br 1P001MUR [0,1,0,0,0,0|1,1,1]=4 976 B10R1.22 Cc1[nH]c(=O)[nH]c(=O)c1C 1P002T48 [0,1,0,0,0,0|2,0,1]=4 977 B10R1.22 Cc1[nH]c(=O)[nH]c(=O)c1Cl 1P001S7C [0,1,0,0,0,0|1,1,1]=4 978 B10R1.22 Cc1[nH]c(=O)[nH]c(=O)c1I 1P001E5F [0,1,0,0,0,0|1,1,1]=4 979 B10R1.22 Cc1[nH]c(C)c(c(=N)n1)C 1P01EKJF [0,1,0,0,0,0|3,0,0]=4 980 B10R1.22 Cc1[nH]c(Cl)c(c(=O)n1)C 1P000J67 [0,1,0,0,0,0|3,0,0]=4 981 B10R1.22 Cc1c(O)cc(=O)[nH]c1C 1P0036VT [0,1,0,0,0,0|3,0,0]=4 982 B10R1.22 Cc1c(O)cc(=O)[nH]c1Cl 1P01B9J7 [0,1,0,0,0,0|3,0,0]=4 983 B10R1.22 Cc1cc(Br)c(c(n1)C)F 1P00CMW5 [0,1,0,0,0,0|3,0,0]=4 984 B10R1.22 Cc1cc(N)c(c(c1)Br)F 1P00978U [0,1,0,0,0,0|3,0,0]=4 985 B10R1.22 Cc1cc(N)c(c(n1)C)Br 1P00I6YE [0,1,0,0,0,0|2,1,0]=4 986 B10R1.22 Cc1nc(C)c(c(n1)Cl)F 1P01A9F5 [0,1,0,0,0,0|2,0,1]=4 987 B10R1.22 Cc1nc(C)c(c(n1)N)Cl 1P002W7Y [0,1,0,0,0,0|1,1,1]=4 988 B10R1.22 Cc1nc(C)c(c(n1)N)F 1P01EC5E [0,1,0,0,0,0|1,0,1]=3 989 B10R1.22 Cc1nc(Cl)c(c(n1)Cl)F 1P007X66 [0,1,0,0,0,0|2,0,1]=4 990 B10R1.22 Cc1nc(N)[nH]c(=O)c1C 1P003GWW [0,1,0,0,0,0|3,0,0]=4 991 B10R1.22 Cc1nc(N)[nH]c(=O)c1F 1P001RT1 [0,1,0,0,0,0|2,0,0]=3 992 B10R1.22 Cc1nc(N)c(c(n1)Cl)C 1P0024HA [0,1,0,0,0,0|2,0,1]=4 993 B10R1.22 Cc1nc(N)c(c(n1)Cl)F 1P00III8 [0,1,0,0,0,0|1,0,1]=3 994 B10R1.22 Cc1nc(N)c(c(n1)Cl)I 1P01C1UH [0,1,0,0,0,0|1,1,1]=4 995 B10R1.22 Cc1nc(N)c(c(n1)Cl)N 1P00GYA0 [0,1,0,0,0,0|2,0,1]=4 996 B10R1.22 Cc1nc(O)c(c(=O)[nH]1)C 1P000J66 [0,1,0,0,0,0|3,0,0]=4 997 B10R1.22 Cc1nc(O)c(c(n1)Cl)F 1P008ZNR [0,1,0,0,0,0|2,0,1]=4 998 B10R1.22 Clc1[nH]c(=O)[nH]c(=O)c1C 1P001TT7 [0,1,0,0,0,0|2,0,1]=4 999 B10R1.22 Clc1cc(N)c(c(c1)Br)F 1P000TY5 [0,1,0,0,0,0|3,0,0]=4 1000 B10R1.22 Clc1cc(N)c(c(c1)Br)F 1P0019L4 [0,1,0,0,0,0|3,0,0]=4 1001 B10R1.22 Clc1cc(N)c(c(c1)Cl)F 1P001BKJ [0,1,0,0,0,0|3,0,0]=4 1002 B10R1.22 Clc1cc(N)c(c(c1)F)F 1P01BI8N [0,1,0,0,0,0|3,0,0]=4 1003 B10R1.22 Clc1cc(N)c(c(n1)Cl)Br 1P01DED9 [0,1,0,0,0,0|2,1,0]=4 1004 B10R1.22 Clc1cc(N)c(c(n1)Cl)Cl 1P00IF2A [0,1,0,0,0,0|2,1,0]=4 1005 B10R1.22 Clc1cc(N)c(c(n1)Cl)F 1P01WUO7 [0,1,0,0,0,0|2,0,0]=3 1006 B10R1.22 Clc1cc(N)c(c(n1)Cl)I 1P019FHX [0,1,0,0,0,0|2,1,0]=4 1007 B10R1.22 Clc1cc(N)c(c(n1)Cl)N 1P00044L [0,1,0,0,0,0|3,0,0]=4 1008 B10R1.22 Clc1nc(C)c(c(n1)C)F 1P000IWH [0,1,0,0,0,0|2,0,1]=4 1009 B10R1.22 Clc1nc(C)c(c(n1)Cl)F 1P00IJIE [0,1,0,0,0,0|2,0,1]=4 1010 B10R1.22 Clc1nc(C)c(c(n1)N)Br 1P00DL6Y [0,1,0,0,0,0|1,1,1]=4 1011 B10R1.22 Clc1nc(C)c(c(n1)N)N 1P00EBH0 [0,1,0,0,0,0|2,0,1]=4 1012 B10R1.22 Clc1nc(Cl)c(c(n1)Cl)F 1P0033F5 [0,1,0,0,0,0|2,0,1]=4 1013 B10R1.22 Clc1nc(N)c(c(n1)Cl)Br 1P000409 [0,1,0,0,0,0|1,1,1]=4 1014 B10R1.22 Clc1nc(N)c(c(n1)Cl)Cl 1P002VI1 [0,1,0,0,0,0|1,1,1]=4 1015 B10R1.22 Clc1nc(N)c(c(n1)Cl)N 1P00A1X3 [0,1,0,0,0,0|2,0,1]=4 1016 B10R1.22 Fc1cc(Br)c(c(n1)Br)F 1P0293WM [0,1,0,0,0,0|3,0,0]=4 1017 B10R1.22 Fc1cc(F)c(c(n1)F)F 1P003FUH [0,1,0,0,0,0|3,0,0]=4 1018 B10R1.22 Fc1cc(N)c(c(c1)Br)F 1P000TY4 [0,1,0,0,0,0|3,0,0]=4 1019 B10R1.22 Fc1cc(N)c(c(c1)Br)F 1P01BG3K [0,1,0,0,0,0|3,0,0]=4 1020 B10R1.22 Fc1cc(N)c(c(c1)Cl)F 1P028777 [0,1,0,0,0,0|3,0,0]=4 1021 B10R1.22 Fc1cc(N)c(c(c1)F)F 1P003FVZ [0,1,0,0,0,0|3,0,0]=4 1022 B10R1.22 Fc1cc(N)c(c(n1)F)Cl 1P00773Q [0,1,0,0,0,0|2,1,0]=4 1023 B10R1.22 Fc1cc(N)c(c(n1)F)F 1P00EFYE [0,1,0,0,0,0|2,0,0]=3 1024 B10R1.22 Fc1cc(N)c(c(n1)F)N 1P00F4L0 [0,1,0,0,0,0|3,0,0]=4 1025 B10R1.22 Fc1cc(N)c(c(n1)O)Cl 1P028BAI [0,1,0,0,0,0|2,1,0]=4 1026 B10R1.22 Nc1[nH]c(=N)[nH]c(=N)c1N 1P00IA34 [0,1,0,0,0,0|2,0,1]=4 1027 B10R1.22 Nc1[nH]c(=O)[nH]c(=O)c1Br 1P00EGKV [0,1,0,0,0,0|0,1,1]=3 1028 B10R1.22 Nc1[nH]c(=O)[nH]c(=O)c1Cl 1P00DGI9 [0,1,0,0,0,0|0,1,1]=3 1029 B10R1.22 Nc1[nH]c(=O)[nH]c(=O)c1F 1P00BTM1 [0,1,0,0,0,0|0,0,1]=2 1030 B10R1.22 Nc1[nH]c(=O)[nH]c(=O)c1N 1P00C8T8 [0,1,0,0,0,0|1,0,1]=3 1031 B10R1.22 Nc1[nH]c(=O)[nH]c(=O)c1O 1P00CXNO [0,1,0,0,0,0|1,0,1]=3 1032 B10R1.22 Nc1[nH]c(=S)[nH]c(=O)c1N 1P0002DB [0,1,0,0,0,0|1,1,1]=4 1033 B10R1.22 Nc1[nH]c(=S)[nH]c(=S)c1N 1P00BZZN [0,1,0,0,0,0|1,1,1]=4 1034 B10R1.22 Nc1[nH]c(N)c(c(=O)n1)N 1P0076DB [0,1,0,0,0,0|2,0,0]=3 1035 B10R1.22 Nc1nc(C)c(c(n1)N)I 1P00AEPN [0,1,0,0,0,0|1,1,1]=4 1036 B10R1.22 Nc1nc(Cl)c(c(n1)Cl)F 1P001OVA [0,1,0,0,0,0|2,0,1]=4 1037 B10R1.22 Nc1nc(N)c(c(=O)[nH]1)N 1P0032PN [0,1,0,0,0,0|3,0,0]=4 1038 B10R1.22 Nc1nc(N)c(c(=O)[nH]1)N 1P00869H [0,1,0,0,0,0|3,0,0]=4 1039 B10R1.22 Nc1nc(N)c(c(n1)Cl)Cl 1P00H2OM [0,1,0,0,0,0|1,1,1]=4 1040 B10R1.22 Nc1nc(N)c(c(n1)Cl)N 1P000J64 [0,1,0,0,0,0|2,0,1]=4 1041 B10R1.22 Nc1nc(N)c(c(n1)N)I 1P01FEW7 [0,1,0,0,0,0|1,1,1]=4 1042 B10R1.22 Nc1nc(N)c(c(n1)N)N 1P0002DC [0,1,0,0,0,0|2,0,1]=4 1043 B10R1.22 Nc1nc(N)c(c(n1)N)N 1P00I8AS [0,1,0,0,0,0|2,0,1]=4 1044 B10R1.22 Nc1nc(N)c(c(n1)O)I 1P00IV8O [0,1,0,0,0,0|1,1,1]=4 1045 B10R1.22 Nc1nc(N)c(c(n1)O)N 1P00395X [0,1,0,0,0,0|2,0,1]=4 1046 B10R1.22 O=C1NC(=O)C(=O)C(=O)N1 1P0034WH [0,1,0,0,0,0|2,0,1]=4 1047 B10R1.22 O=C1NC(=O)C(=O)C(=O)N1 1P003UJK [0,1,0,0,0,0|2,0,1]=4 1048 B10R1.22 O=C1NC(=O)C(=O)C(=O)N1 1P00E973 [0,1,0,0,0,0|2,0,1]=4 1049 B10R1.22 O=c1nc(C)[nH]c(c1Br)O 1P00DIIZ [0,1,0,0,0,0|2,1,0]=4 1050 B10R1.22 O=c1nc(C)[nH]c(c1F)C 1P006RE9 [0,1,0,0,0,0|2,0,0]=3 1051 B10R1.22 O=c1nc(C)c(c([nH]1)C)Br 1P00GA60 [0,1,0,0,0,0|1,1,0]=3 1052 B10R1.22 O=c1nc(N)[nH]c(c1Br)Cl 1P00DNK7 [0,1,0,0,0,0|2,1,0]=4 1053 B10R1.22 O=c1nc(N)[nH]c(c1Br)N 1P003GIL [0,1,0,0,0,0|1,1,0]=3 1054 B10R1.22 O=c1nc(N)[nH]c(c1O)C 1P00B391 [0,1,0,0,0,0|3,0,0]=4 1055 B10R1.22 O=c1nc(N)c(c([nH]1)N)N 1P008NNM [0,1,0,0,0,0|1,0,0]=2 1056 B10R1.22 Oc1nc(C)[nH]c(=O)c1F 1P001RV4 [0,1,0,0,0,0|2,0,0]=3 1057 B10R1.22 Oc1nc(N)c(c(n1)O)N 1P003MQ7 [0,1,0,0,0,0|1,0,2]=4 1058 B10R1.22 Oc1nc(N)c(c(n1)O)N 1P007I70 [0,1,0,0,0,0|1,0,2]=4 1059 B10R1.22 Oc1nc(N)c(c(n1)O)N 1P00I6LN [0,1,0,0,0,0|1,0,2]=4 1060 B10R1.22 Oc1nc(O)c(c(n1)O)F 1P005ISN [0,1,0,0,0,0|1,0,2]=4 1061 B10R1.22 c1([2H])c([2H])c(N)[nH]c(=O)n1 1P0095B9 [0,1,0,0,0,0|1,0,0]=2 1062 B10R1.25 BrCc1cnc(nc1N)C 1P002XQ6 [0,1,0,0,0,0|1,1,1]=4 1063 B10R1.25 BrCc1cnc(nc1N)N 1P028U26 [0,1,0,0,0,0|1,1,1]=4 1064 B10R1.25 C#Cc1c[nH]c(=O)[nH]c1=O 1P00EF3M [0,1,0,0,0,0|2,0,1]=4 1065 B10R1.25 C=Cc1c[nH]c(=O)[nH]c1=O 1P003NFJ [0,1,0,0,0,0|2,0,1]=4 1066 B10R1.25 CCc1c[nH]c(=O)[nH]c1=O 1P003G9P [0,1,0,0,0,0|2,0,1]=4 1067 B10R1.25 CNc1c[nH]c(=O)[nH]c1=O 1P005IV7 [0,1,0,0,0,0|2,0,1]=4 1068 B10R1.25 CNc1cnc(cc1N)Br 1P00HGYQ [0,1,0,0,0,0|3,0,0]=4 1069 B10R1.25 CNc1cnc(cc1N)Cl 1P01XCXG [0,1,0,0,0,0|3,0,0]=4 1070 B10R1.25 COc1c[nH]c(=O)[nH]c1=O 1P006P54 [0,1,0,0,0,0|2,0,1]=4 1071 B10R1.25 COc1cnc(cc1N)Br 1P001HGW [0,1,0,0,0,0|3,0,0]=4 1072 B10R1.25 COc1cnc(cc1N)Cl 1P000JT2 [0,1,0,0,0,0|3,0,0]=4 1073 B10R1.25 COc1cnc(cc1N)F 1P01BWH4 [0,1,0,0,0,0|3,0,0]=4 1074 B10R1.25 COc1cnc(nc1N)C 1P00FU04 [0,1,0,0,0,0|2,0,1]=4 1075 B10R1.25 COc1cnc(nc1N)Cl 1P003W4Q [0,1,0,0,0,0|2,0,1]=4 1076 B10R1.25 Cc1cc(N)c(cn1)C#N 1P00ILKG [0,1,0,0,0,0|3,0,0]=4 1077 B10R1.25 Cc1cc(N)c(cn1)CO 1P001PWE [0,1,0,0,0,0|3,0,0]=4 1078 B10R1.25 Cc1ncc(c(=N)[nH]1)CN 1P00IJ53 [0,1,0,0,0,0|2,0,1]=4 1079 B10R1.25 ClCc1c[nH]c(=O)[nH]c1=O 1P003MNU [0,1,0,0,0,0|1,1,1]=4 1080 B10R1.25 N#Cc1c[nH]c(=O)[nH]c1=O 1P0072PW [0,1,0,0,0,0|2,0,1]=4 1081 B10R1.25 N#Cc1cnc(nc1N)Br 1P0068YH [0,1,0,0,0,0|2,0,1]=4 1082 B10R1.25 N#Cc1cnc(nc1N)C 1P005U15 [0,1,0,0,0,0|2,0,1]=4 1083 B10R1.25 N#Cc1cnc(nc1N)Cl 1P0038Z6 [0,1,0,0,0,0|2,0,1]=4 1084 B10R1.25 N#Cc1cnc(nc1N)N 1P001VGQ [0,1,0,0,0,0|2,0,1]=4 1085 B10R1.25 NCc1c[nH]c(=O)[nH]c1=O 1P00J1FV [0,1,0,0,0,0|2,0,1]=4 1086 B10R1.25 NCc1cnc(nc1N)C 1P000JCM [0,1,0,0,0,0|2,0,1]=4 1087 B10R1.25 NCc1cnc(nc1N)C 1P00GYAX [0,1,0,0,0,0|2,0,1]=4 1088 B10R1.25 Nc1c(C=C)cnc(=O)[nH]1 1P00BUA5 [0,1,0,0,0,0|1,0,0]=2 1089 B10R1.25 Nc1c(cnc(=O)[nH]1)C#C 1P00EYEQ [0,1,0,0,0,0|1,0,0]=2 1090 B10R1.25 Nc1c(cnc(=O)[nH]1)C#N 1P001VGP [0,1,0,0,0,0|1,0,0]=2 1091 B10R1.25 Nc1c(cnc(=S)[nH]1)C#N 1P001VGR [0,1,0,0,0,0|1,1,0]=3 1092 B10R1.25 Nc1cc(Br)ncc1C#N 1P028B88 [0,1,0,0,0,0|3,0,0]=4 1093 B10R1.25 Nc1cc(Cl)ncc1C=O 1P0001LT [0,1,0,0,0,0|3,0,0]=4 1094 B10R1.25 Nc1cc(Cl)ncc1CO 1P0051IB [0,1,0,0,0,0|3,0,0]=4 1095 B10R1.25 Nc1cc(N)ncc1C#N 1P005IVC [0,1,0,0,0,0|3,0,0]=4 1096 B10R1.25 Nc1nc(=O)[nH]cc1CO 1P00834T [0,1,0,0,0,0|1,0,2]=4 1097 B10R1.25 Nc1ncc(c(=O)[nH]1)C=O 1P01KFKW [0,1,0,0,0,0|3,0,0]=4 1098 B10R1.25 O=Cc1c[nH]c(=O)[nH]c1=O 1P000JCL [0,1,0,0,0,0|2,0,1]=4 1099 B10R1.25 O=Cc1ccc(=O)[nH]c1C 1P0207HL [0,1,0,0,0,0|3,0,0]=4 1100 B10R1.25 O=Cc1cnc(nc1N)C 1P005M9Z [0,1,0,0,0,0|2,0,1]=4 1101 B10R1.25 O=Cc1cnc(nc1N)Cl 1P01FPDW [0,1,0,0,0,0|2,0,1]=4 1102 B10R1.25 O=Cc1cnc(nc1N)N 1P002JSF [0,1,0,0,0,0|2,0,1]=4 1103 B10R1.25 OCC1C=NC(=O)NC1=O 1P003N9I [0,1,0,0,0,0|2,0,1]=4 1104 B10R1.25 OCc1cnc(nc1N)C 1P005CG4 [0,1,0,0,0,0|2,0,1]=4 1105 B10R1.25 OCc1cnc(nc1N)C 1P01KL2M [0,1,0,0,0,0|2,0,1]=4 1106 B10R1.25 OCc1cnc(nc1N)Cl 1P01DL6U [0,1,0,0,0,0|2,0,1]=4 1107 B10R1.25 OCc1cnc(nc1N)N 1P00C17C [0,1,0,0,0,0|2,0,1]=4 1108 B10R1.30 BrCc1cc(O)ncc1F 1P01EMUL [0,1,0,0,0,0|2,0,1]=4 1109 B10R1.30 Brc1ccc(=O)[nH]c1C#N 1P01DMYO [0,1,0,0,0,0|1,1,1]=4 1110 B10R1.30 C#Cc1cc(Cl)ncc1F 1P009IUJ [0,1,0,0,0,0|3,0,0]=4 1111 B10R1.30 C#Cc1cc(F)ncc1F 1P027TVP [0,1,0,0,0,0|3,0,0]=4 1112 B10R1.30 C#Cc1nc(Cl)ncc1F 1P028VDQ [0,1,0,0,0,0|2,0,1]=4 1113 B10R1.30 CCc1nc(Cl)ncc1F 1P0013GK [0,1,0,0,0,0|2,0,1]=4 1114 B10R1.30 CNc1cc(Br)ccc1F 1P000H24 [0,1,0,0,0,0|3,0,0]=4 1115 B10R1.30 CNc1cc(F)ccc1F 1P01A91H [0,1,0,0,0,0|3,0,0]=4 1116 B10R1.30 CNc1cc(O)ccc1F 1P028J1A [0,1,0,0,0,0|2,0,1]=4 1117 B10R1.30 CNc1nc(Cl)ncc1Br 1P00BJWX [0,1,0,0,0,0|1,1,1]=4 1118 B10R1.30 CNc1nc(Cl)ncc1Cl 1P00H664 [0,1,0,0,0,0|1,1,1]=4 1119 B10R1.30 CNc1nc(Cl)ncc1F 1P00FC9H [0,1,0,0,0,0|1,0,1]=3 1120 B10R1.30 CNc1nc(N)ncc1F 1P00FYWX [0,1,0,0,0,0|1,0,1]=3 1121 B10R1.30 COc1c(F)cnc(=O)[nH]1 1P00BU7P [0,1,0,0,0,0|1,0,0]=2 1122 B10R1.30 COc1cc(Br)ncc1F 1P00HIV9 [0,1,0,0,0,0|3,0,0]=4 1123 B10R1.30 COc1cc(Cl)ncc1F 1P0096Z9 [0,1,0,0,0,0|3,0,0]=4 1124 B10R1.30 COc1nc(Br)ncc1F 1P01NWJF [0,1,0,0,0,0|2,0,1]=4 1125 B10R1.30 COc1nc(Cl)ncc1F 1P0079YO [0,1,0,0,0,0|2,0,1]=4 1126 B10R1.30 CSc1cc(Cl)ncc1F 1P01DFRH [0,1,0,0,0,0|3,0,0]=4 1127 B10R1.30 CSc1nc(Cl)ncc1F 1P00IF8A [0,1,0,0,0,0|2,0,1]=4 1128 B10R1.30 N#Cc1cc(Br)ncc1F 1P000OWT [0,1,0,0,0,0|2,0,1]=4 1129 B10R1.30 NCc1[nH]c(=O)ccc1C 1P028ELY [0,1,0,0,0,0|2,0,0]=3 1130 B10R1.30 NCc1cc(Br)ccc1F 1P0028Z5 [0,1,0,0,0,0|3,0,0]=4 1131 B10R1.30 NCc1cc(Br)ccc1F 1P002F6A [0,1,0,0,0,0|3,0,0]=4 1132 B10R1.30 NCc1cc(Br)ncc1Br 1P028YQA [0,1,0,0,0,0|2,1,0]=4 1133 B10R1.30 NCc1cc(C)ccc1F 1P00GYLW [0,1,0,0,0,0|3,0,0]=4 1134 B10R1.30 NCc1cc(C)ccc1F 1P01DYZ5 [0,1,0,0,0,0|3,0,0]=4 1135 B10R1.30 NCc1cc(Cl)ccc1F 1P002SG9 [0,1,0,0,0,0|3,0,0]=4 1136 B10R1.30 NCc1cc(Cl)ncc1Br 1P028RHL [0,1,0,0,0,0|2,1,0]=4 1137 B10R1.30 NCc1cc(Cl)ncc1Cl 1P0283YJ [0,1,0,0,0,0|2,1,0]=4 1138 B10R1.30 NCc1cc(Cl)ncc1Cl 1P02847U [0,1,0,0,0,0|2,1,0]=4 1139 B10R1.30 NCc1cc(F)ccc1F 1P003BLY [0,1,0,0,0,0|3,0,0]=4 1140 B10R1.30 NCc1cc(I)ccc1F 1P0282O0 [0,1,0,0,0,0|3,0,0]=4 1141 B10R1.30 NCc1cc(N)ccc1F 1P005EAR [0,1,0,0,0,0|3,0,0]=4 1142 B10R1.30 NCc1cc(N)ccc1F 1P028A8B [0,1,0,0,0,0|3,0,0]=4 1143 B10R1.30 NCc1cc(O)ccc1F 1P023JAH [0,1,0,0,0,0|2,0,1]=4 1144 B10R1.30 NCc1nc(C)ccc1F 1P009DVJ [0,1,0,0,0,0|2,0,1]=4 1145 B10R1.30 NCc1nc(Cl)ccc1F 1P01KLI7 [0,1,0,0,0,0|2,0,1]=4 1146 B10R1.30 NNc1cc(Br)ccc1F 1P00C2JK [0,1,0,0,0,0|3,0,0]=4 1147 B10R1.30 NNc1cc(C)ccc1F 1P00BUMA [0,1,0,0,0,0|3,0,0]=4 1148 B10R1.30 NNc1cc(C)ccc1F 1P00CMBI [0,1,0,0,0,0|3,0,0]=4 1149 B10R1.30 NNc1cc(Cl)ccc1F 1P00DAX0 [0,1,0,0,0,0|3,0,0]=4 1150 B10R1.30 NNc1cc(F)ccc1F 1P0020NV [0,1,0,0,0,0|3,0,0]=4 1151 B10R1.30 NNc1cc(F)ccc1F 1P003BM0 [0,1,0,0,0,0|3,0,0]=4 1152 B10R1.30 NNc1cc(O)ccc1F 1P0283A2 [0,1,0,0,0,0|2,0,1]=4 1153 B10R1.30 NNc1nc(C)ccc1F 1P028VYH [0,1,0,0,0,0|2,0,1]=4 1154 B10R1.30 NNc1nc(C)ncc1C 1P01FJMG [0,1,0,0,0,0|2,0,1]=4 1155 B10R1.30 NNc1nc(Cl)ncc1Br 1P024XIF [0,1,0,0,0,0|1,1,1]=4 1156 B10R1.30 NNc1nc(Cl)ncc1F 1P00HSYK [0,1,0,0,0,0|1,0,1]=3 1157 B10R1.30 NNc1nc(F)ccc1F 1P01BVXP [0,1,0,0,0,0|2,0,1]=4 1158 B10R1.30 O=Cc1cc(Br)ncc1F 1P0002QG [0,1,0,0,0,0|3,0,0]=4 1159 B10R1.30 O=Cc1cc(Cl)ncc1F 1P008D47 [0,1,0,0,0,0|3,0,0]=4 1160 B10R1.30 O=Cc1cc(F)ncc1F 1P01BBJW [0,1,0,0,0,0|3,0,0]=4 1161 B10R1.30 OCc1cc(C)ncc1F 1P01JWI2 [0,1,0,0,0,0|3,0,0]=4 1162 B10R1.30 OCc1cc(Cl)ncc1F 1P004HS1 [0,1,0,0,0,0|3,0,0]=4 1163 B10R1.30 OCc1cc(F)ncc1F 1P01BBA5 [0,1,0,0,0,0|3,0,0]=4 1164 B10R1.118 Brc1cc(F)c(=O)[nH]c1C 1P028DAW [0,1,0,0,0,0|2,1,0]=4 1165 B10R1.118 Brc1cc(F)c(cc1C)N 1P00C6RS [0,1,0,0,0,0|3,0,0]=4 1166 B10R1.118 Brc1cc(N)c(cc1C)F 1P0038ZC [0,1,0,0,0,0|3,0,0]=4 1167 B10R1.118 Brc1cn(C)c(=O)[nH]c1=O 1P003MWF [0,1,0,0,0,0|1,1,1]=4 1168 B10R1.118 Brc1cn(N)c(=O)[nH]c1=O 1P000Y4A [0,1,0,0,0,0|1,1,1]=4 1169 B10R1.118 Cc1[nH]c(=O)c(cc1C)Br 1P009EFM [0,1,0,0,0,0|3,0,0]=4 1170 B10R1.118 Cc1[nH]c(=O)c(cc1C)N 1P009EC3 [0,1,0,0,0,0|3,0,0]=4 1171 B10R1.118 Cc1cc(F)c(cc1C)N 1P01DXA8 [0,1,0,0,0,0|3,0,0]=4 1172 B10R1.118 Cc1cc(F)c(cc1F)N 1P008D8K [0,1,0,0,0,0|3,0,0]=4 1173 B10R1.118 Cc1cc(F)c(cc1N)N 1P01DHVZ [0,1,0,0,0,0|3,0,0]=4 1174 B10R1.118 Cc1cc(N)c(cc1N)F 1P000B5I [0,1,0,0,0,0|3,0,0]=4 1175 B10R1.118 Cc1cn(C)c(=O)[nH]c1=O 1P00C0UD [0,1,0,0,0,0|2,0,1]=4 1176 B10R1.118 Clc1[nH]c(=O)c(cc1Cl)Cl 1P003J0D [0,1,0,0,0,0|2,1,0]=4 1177 B10R1.118 Clc1cc(F)c(cc1C)N 1P000DN2 [0,1,0,0,0,0|3,0,0]=4 1178 B10R1.118 Clc1cc(N)c(cc1C)F 1P01AGQQ [0,1,0,0,0,0|3,0,0]=4 1179 B10R1.118 Fc1[nH]c(=O)c(cc1F)F 1P0033ZM [0,1,0,0,0,0|2,0,0]=3 1180 B10R1.118 Fc1cc(Br)c(cc1N)Cl 1P000CSO [0,1,0,0,0,0|3,0,0]=4 1181 B10R1.118 Fc1cc(Br)c(cc1N)O 1P01FLNC [0,1,0,0,0,0|2,0,1]=4 1182 B10R1.118 Fc1cc(Cl)c(cc1N)Br 1P0083FV [0,1,0,0,0,0|3,0,0]=4 1183 B10R1.118 Fc1cc(Cl)c(cc1N)Cl 1P00BGLL [0,1,0,0,0,0|3,0,0]=4 1184 B10R1.118 Fc1cc(Cl)c(cc1N)Cl 1P0283FG [0,1,0,0,0,0|3,0,0]=4 1185 B10R1.118 Fc1cc(Cl)c(cc1N)I 1P00HUBE [0,1,0,0,0,0|3,0,0]=4 1186 B10R1.118 Fc1cc(Cl)c(cc1N)O 1P004SJ7 [0,1,0,0,0,0|2,0,1]=4 1187 B10R1.118 Fc1cc(F)c(cc1N)F 1P003G2F [0,1,0,0,0,0|3,0,0]=4 1188 B10R1.118 Fc1cc(F)c(cc1N)N 1P01A0B6 [0,1,0,0,0,0|3,0,0]=4 1189 B10R1.118 Fc1cc(F)c(nc1N)F 1P00BXW1 [0,1,0,0,0,0|2,0,1]=4 1190 B10R1.118 Fc1cc(F)c(nc1N)N 1P002PKD [0,1,0,0,0,0|2,0,1]=4 1191 B10R1.118 Fc1cc(O)c(cc1N)Br 1P021WEB [0,1,0,0,0,0|3,0,0]=4 1192 B10R1.118 Fc1cc(O)c(cc1N)Cl 1P00DMDN [0,1,0,0,0,0|3,0,0]=4 1193 B10R1.118 Fc1cc(O)c(cc1N)I 1P01DFLO [0,1,0,0,0,0|3,0,0]=4 1194 B10R1.118 Fc1cn(C)c(=O)[nH]c1=O 1P001O0C [0,1,0,0,0,0|1,0,1]=3 1195 B10R1.118 Fc1cn(C)c(=O)cc1Br 1P000J2V [0,1,0,0,0,0|2,0,1]=4 1196 B10R1.118 Ic1cc(N)c(cc1C)F 1P01FHWL [0,1,0,0,0,0|3,0,0]=4 1197 B10R1.118 Ic1cn(C)c(=O)[nH]c1=O 1P00IMP5 [0,1,0,0,0,0|1,1,1]=4 1198 B10R1.118 NC1=CC(=O)C(=CC1=O)N 1P007K8P [0,1,0,0,0,0|3,0,0]=4 1199 B10R1.118 Nc1[nH]c(=N)c(cc1Br)Br 1P00G33I [0,1,0,0,0,0|2,1,0]=4 1200 B10R1.118 Nc1cc(=O)n(cc1Br)C 1P01ELSM [0,1,0,0,0,0|1,1,1]=4 1201 B10R1.118 Nc1cc(Br)c(=O)[nH]c1C 1P028O58 [0,1,0,0,0,0|3,0,0]=4 1202 B10R1.118 Nc1cc(Br)c(cc1F)F 1P003MX6 [0,1,0,0,0,0|3,0,0]=4 1203 B10R1.118 Nc1cc(Cl)c(cc1F)F 1P00C0QA [0,1,0,0,0,0|3,0,0]=4 1204 B10R1.118 Nc1cc(F)c(cc1F)Br 1P003LCC [0,1,0,0,0,0|3,0,0]=4 1205 B10R1.118 Nc1cc(F)c(cc1F)Cl 1P002S99 [0,1,0,0,0,0|3,0,0]=4 1206 B10R1.118 Nc1cc(F)c(cc1F)I 1P001OSV [0,1,0,0,0,0|3,0,0]=4 1207 B10R1.118 Nc1cc(F)c(cc1F)N 1P00ICG8 [0,1,0,0,0,0|3,0,0]=4 1208 B10R1.118 Nc1cc(F)c(cc1F)N 1P01DWVU [0,1,0,0,0,0|3,0,0]=4 1209 B10R1.118 Nc1cc(F)c(cc1F)O 1P000QS3 [0,1,0,0,0,0|3,0,0]=4 1210 B10R1.118 Nc1cc(O)c(cc1F)F 1P0009AV [0,1,0,0,0,0|2,0,1]=4 1211 B10R1.118 Nc1cn(C)c(=O)[nH]c1=O 1P01A0U6 [0,1,0,0,0,0|2,0,1]=4 1212 B10R1.118 Nc1nc(F)c(cc1F)Br 1P01KZMC [0,1,0,0,0,0|2,0,1]=4 1213 B10R1.118 Nc1nc(F)c(cc1F)Cl 1P01JZA6 [0,1,0,0,0,0|2,0,1]=4 1214 B10R1.118 Nc1nc(F)c(cc1F)I 1P028AVD [0,1,0,0,0,0|2,0,1]=4 1215 B10R1.118 Oc1cn(C)c(=O)[nH]c1=O 1P01C4TB [0,1,0,0,0,0|2,0,1]=4 1216 B10R1.119 Brc1ccc(=O)n(c1C)C 1P01Z4TV [0,1,0,0,0,0|2,1,0]=4 1217 B10R1.119 Brc1ccc(=O)n(c1Cl)C 1P01WK80 [0,1,0,0,0,0|2,1,0]=4 1218 B10R1.119 Brc1ccc(c(c1C)N)F 1P00HHCX [0,1,0,0,0,0|3,0,0]=4 1219 B10R1.119 Brc1cnc(c(c1N)Br)C 1P000T12 [0,1,0,0,0,0|2,1,0]=4 1220 B10R1.119 Brc1cnc(c(c1N)Br)Cl 1P008UZD [0,1,0,0,0,0|2,1,0]=4 1221 B10R1.119 Brc1cnc(c(c1N)C)Cl 1P028YGE [0,1,0,0,0,0|2,1,0]=4 1222 B10R1.119 Brc1cnc(c(c1N)F)Cl 1P028TX1 [0,1,0,0,0,0|2,1,0]=4 1223 B10R1.119 Brc1cnc(c(c1N)I)Br 1P000JK0 [0,1,0,0,0,0|2,1,0]=4 1224 B10R1.119 Brc1cnc(c(c1N)I)Cl 1P00ILJB [0,1,0,0,0,0|2,1,0]=4 1225 B10R1.119 Brc1cnc(c(c1N)N)Br 1P0033YV [0,1,0,0,0,0|2,1,0]=4 1226 B10R1.119 Brc1cnc(c(c1N)N)Cl 1P001UKP [0,1,0,0,0,0|2,1,0]=4 1227 B10R1.119 Cc1cnc(c(c1N)Br)Cl 1P0293S9 [0,1,0,0,0,0|3,0,0]=4 1228 B10R1.119 Cc1cnc(c(c1N)N)Cl 1P00243M [0,1,0,0,0,0|3,0,0]=4 1229 B10R1.119 Cc1ncc(c(c1C)N)C 1P0280V3 [0,1,0,0,0,0|3,0,0]=4 1230 B10R1.119 Clc1cnc(c(c1N)Cl)C 1P00ADL0 [0,1,0,0,0,0|2,1,0]=4 1231 B10R1.119 Clc1cnc(c(c1N)Cl)Cl 1P00BDUQ [0,1,0,0,0,0|2,1,0]=4 1232 B10R1.119 Clc1cnc(c(c1N)F)Cl 1P028TRQ [0,1,0,0,0,0|2,1,0]=4 1233 B10R1.119 Clc1cnc(c(c1N)N)Cl 1P00CLPJ [0,1,0,0,0,0|2,1,0]=4 1234 B10R1.119 Fc1ccc(c(c1F)N)F 1P003FWG [0,1,0,0,0,0|3,0,0]=4 1235 B10R1.119 Fc1ccc(c(c1N)Br)C 1P01BF91 [0,1,0,0,0,0|3,0,0]=4 1236 B10R1.119 Fc1ccc(c(c1N)Br)Cl 1P01FHQT [0,1,0,0,0,0|3,0,0]=4 1237 B10R1.119 Fc1ccc(c(c1N)Cl)C 1P00GYLE [0,1,0,0,0,0|3,0,0]=4 1238 B10R1.119 Fc1ccc(c(c1N)Cl)C 1P027VNV [0,1,0,0,0,0|3,0,0]=4 1239 B10R1.119 Fc1ccc(c(c1N)F)Br 1P009HTV [0,1,0,0,0,0|3,0,0]=4 1240 B10R1.119 Fc1ccc(c(c1N)F)Br 1P01ELLY [0,1,0,0,0,0|3,0,0]=4 1241 B10R1.119 Fc1ccc(c(c1N)F)C 1P00AQC6 [0,1,0,0,0,0|3,0,0]=4 1242 B10R1.119 Fc1ccc(c(c1N)F)C 1P028Z38 [0,1,0,0,0,0|3,0,0]=4 1243 B10R1.119 Fc1ccc(c(c1N)F)Cl 1P002WP9 [0,1,0,0,0,0|3,0,0]=4 1244 B10R1.119 Fc1ccc(c(c1N)F)Cl 1P028YB7 [0,1,0,0,0,0|3,0,0]=4 1245 B10R1.119 Fc1ccc(c(c1N)F)N 1P028V4Q [0,1,0,0,0,0|3,0,0]=4 1246 B10R1.119 Fc1ccc(c(c1N)N)Br 1P01FHBW [0,1,0,0,0,0|3,0,0]=4 1247 B10R1.119 Fc1cnc(c(c1C)F)N 1P000WO9 [0,1,0,0,0,0|3,0,0]=4 1248 B10R1.119 Fc1cnc(c(c1I)C)Cl 1P00GT16 [0,1,0,0,0,0|3,0,0]=4 1249 B10R1.119 Fc1cnc(c(c1I)F)N 1P028RF7 [0,1,0,0,0,0|3,0,0]=4 1250 B10R1.119 Fc1cnc(c(c1N)N)Cl 1P00773O [0,1,0,0,0,0|2,0,0]=3 1251 B10R1.119 Fc1ncc(c(c1F)I)F 1P007XH8 [0,1,0,0,0,0|3,0,0]=4 1252 B10R1.119 Ic1cnc(c(c1N)F)Cl 1P01X9XV [0,1,0,0,0,0|2,1,0]=4 1253 B10R1.119 Ic1cnc(c(c1N)F)Cl 1P024SO4 [0,1,0,0,0,0|2,1,0]=4 1254 B10R1.119 Ic1cnc(c(c1N)I)Br 1P001494 [0,1,0,0,0,0|2,1,0]=4 1255 B10R1.119 Ic1cnc(c(c1N)I)C 1P000JIQ [0,1,0,0,0,0|2,1,0]=4 1256 B10R1.119 Ic1cnc(c(c1N)I)Cl 1P000ECU [0,1,0,0,0,0|2,1,0]=4 1257 B10R1.119 Ic1cnc(n(c1=O)C)Cl 1P01XBUB [0,1,0,0,0,0|2,1,0]=4 1258 B10R1.119 Nc1c(F)ccc(c1N)F 1P01A5F3 [0,1,0,0,0,0|3,0,0]=4 1259 B10R1.176 C#Cc1ccc(c(c1)N)F 1P01FT1N [0,1,0,0,0,0|3,0,0]=4 1260 B10R1.176 CCc1ncc(c(=O)[nH]1)Br 1P01DW0D [0,1,0,0,0,0|2,1,0]=4 1261 B10R1.176 CCc1ncc(c(n1)Cl)F 1P01A5SU [0,1,0,0,0,0|2,0,1]=4 1262 B10R1.176 CNc1ncc(c(=O)[nH]1)Br 1P01B8FM [0,1,0,0,0,0|2,1,0]=4 1263 B10R1.176 CNc1ncc(c(n1)N)Br 1P01FM4F [0,1,0,0,0,0|1,1,1]=4 1264 B10R1.176 COc1ccc(c(c1)N)F 1P0037HS [0,1,0,0,0,0|2,0,1]=4 1265 B10R1.176 COc1ccc(c(n1)N)F 1P01UNRP [0,1,0,0,0,0|1,0,2]=4 1266 B10R1.176 COc1ncc(c(=O)[nH]1)F 1P0034QB [0,1,0,0,0,0|1,0,1]=3 1267 B10R1.176 COc1ncc(c(c1)Br)F 1P004K06 [0,1,0,0,0,0|2,0,1]=4 1268 B10R1.176 COc1ncc(c(c1)I)F 1P004HRZ [0,1,0,0,0,0|2,0,1]=4 1269 B10R1.176 COc1ncc(c(c1)N)Br 1P000KOI [0,1,0,0,0,0|1,1,1]=4 1270 B10R1.176 COc1ncc(c(c1)N)C 1P000RGB [0,1,0,0,0,0|2,0,1]=4 1271 B10R1.176 COc1ncc(c(c1)N)Cl 1P028LXH [0,1,0,0,0,0|1,1,1]=4 1272 B10R1.176 COc1ncc(c(c1)N)F 1P00EJ15 [0,1,0,0,0,0|1,0,1]=3 1273 B10R1.176 COc1ncc(c(c1)N)N 1P000XEF [0,1,0,0,0,0|2,0,1]=4 1274 B10R1.176 COc1ncc(c(c1)O)F 1P00DCMA [0,1,0,0,0,0|2,0,1]=4 1275 B10R1.176 COc1ncc(c(n1)Cl)F 1P002268 [0,1,0,0,0,0|1,0,2]=4 1276 B10R1.176 COc1ncc(c(n1)N)Br 1P001FZH [0,1,0,0,0,0|0,1,2]=4 1277 B10R1.176 COc1ncc(c(n1)N)F 1P002CIG [0,1,0,0,0,0|0,0,2]=3 1278 B10R1.176 CSc1ncc(c(=O)[nH]1)Br 1P005KAO [0,1,0,0,0,0|1,2,0]=4 1279 B10R1.176 CSc1ncc(c(=O)[nH]1)C 1P00BGK7 [0,1,0,0,0,0|2,1,0]=4 1280 B10R1.176 CSc1ncc(c(=O)[nH]1)Cl 1P00EA8A [0,1,0,0,0,0|1,2,0]=4 1281 B10R1.176 CSc1ncc(c(n1)Cl)F 1P00EM8C [0,1,0,0,0,0|1,1,1]=4 1282 B10R1.176 CSc1ncc(c(n1)N)Br 1P01DXEB [0,1,0,0,0,0|0,2,1]=4 1283 B10R1.176 CSc1ncc(c(n1)N)F 1P028HZN [0,1,0,0,0,0|0,1,1]=3 1284 B10R1.176 N#Cc1ccc(c(c1)N)F 1P003JC7 [0,1,0,0,0,0|3,0,0]=4 1285 B10R1.176 N#Cc1ncc(c(c1)C)F 1P024I4R [0,1,0,0,0,0|3,0,0]=4 1286 B10R1.176 N#Cc1ncc(c(c1)N)F 1P0026HU [0,1,0,0,0,0|2,0,0]=3 1287 B10R1.176 N#Cc1ncc(c(n1)N)Br 1P0092K0 [0,1,0,0,0,0|1,1,1]=4 1288 B10R1.176 NCc1ncc(c(=O)[nH]1)Br 1P0285DZ [0,1,0,0,0,0|2,1,0]=4 1289 B10R1.176 O=Cc1ccc(c(c1)Br)F 1P00342U [0,1,0,0,0,0|3,0,0]=4 1290 B10R1.176 O=Cc1ccc(c(c1)C)F 1P008022 [0,1,0,0,0,0|3,0,0]=4 1291 B10R1.176 O=Cc1ccc(c(c1)Cl)F 1P00344A [0,1,0,0,0,0|3,0,0]=4 1292 B10R1.176 O=Cc1ccc(c(c1)F)F 1P003IXJ [0,1,0,0,0,0|3,0,0]=4 1293 B10R1.176 O=Cc1ccc(c(c1)I)F 1P00BF5A [0,1,0,0,0,0|3,0,0]=4 1294 B10R1.176 O=Cc1ccc(c(c1)O)F 1P007H5L [0,1,0,0,0,0|3,0,0]=4 1295 B10R1.176 O=Cc1ccc(c(n1)Br)F 1P00HHE9 [0,1,0,0,0,0|2,0,1]=4 1296 B10R1.176 O=Cc1ccc(c(n1)C)F 1P008D3W [0,1,0,0,0,0|2,0,1]=4 1297 B10R1.176 O=Cc1ncc(c(c1)Br)Br 1P028LK6 [0,1,0,0,0,0|2,1,0]=4 1298 B10R1.176 O=Cc1ncc(c(c1)Br)C 1P000PU2 [0,1,0,0,0,0|3,0,0]=4 1299 B10R1.176 O=Cc1ncc(c(c1)Br)Cl 1P01OXVP [0,1,0,0,0,0|2,1,0]=4 1300 B10R1.176 O=Cc1ncc(c(c1)Br)F 1P01PHI3 [0,1,0,0,0,0|2,0,0]=3 1301 B10R1.176 O=Cc1ncc(c(c1)C)Br 1P008AZL [0,1,0,0,0,0|2,1,0]=4 1302 B10R1.176 O=Cc1ncc(c(c1)Cl)Br 1P01Q2N3 [0,1,0,0,0,0|2,1,0]=4 1303 B10R1.176 OCc1ccc(c(c1)N)F 1P007ODJ [0,1,0,0,0,0|2,0,1]=4 1304 B10R1.176 OCc1ccc(c(c1)N)F 1P028QL7 [0,1,0,0,0,0|2,0,1]=4 1305 B10R1.176 OCc1ncc(c(c1)Cl)F 1P008S50 [0,1,0,0,0,0|2,0,1]=4 1306 B10R1.176 OCc1ncc(c(c1)N)C 1P01FM2N [0,1,0,0,0,0|2,0,1]=4 1307 B8R1.18 Brc1[nH]c(c(n1)Br)Br 1P0029CD [0,0,0,0,1,0|2,1,0]=4 1308 B8R1.18 Brc1[nH]c(c(n1)Br)C 1P003GDF [0,0,0,0,1,0|2,1,0]=4 1309 B8R1.18 Brc1[nH]c(c(n1)Cl)Cl 1P001VSE [0,0,0,0,1,0|2,1,0]=4 1310 B8R1.18 Cc1[nH]c(=O)[nH]c1C 1P007TOE [0,0,0,0,1,0|2,0,1]=4 1311 B8R1.18 Cc1[nH]c(c(n1)Br)Br 1P00BY11 [0,0,0,0,1,0|2,1,0]=4 1312 B8R1.18 Cc1[nH]c(c(n1)Br)C 1P00J2KK [0,0,0,0,1,0|2,1,0]=4 1313 B8R1.18 Cc1[nH]c(c(n1)C)C 1P0056FW [0,0,0,0,1,0|3,0,0]=4 1314 B8R1.18 Cc1[nH]c(c(n1)C)C 1P01BURG [0,0,0,0,1,0|3,0,0]=4 1315 B8R1.18 Cc1[nH]c(c(n1)C)I 1P01NWJN [0,0,0,0,1,0|3,0,0]=4 1316 B8R1.18 Cc1[nH]c(c(n1)Cl)Cl 1P001RQX [0,0,0,0,1,0|2,1,0]=4 1317 B8R1.18 Cc1[nH]c(c(n1)I)I 1P003KYS [0,0,0,0,1,0|2,1,0]=4 1318 B8R1.18 Cc1sc(c(n1)C)N 1P00G5DE [0,0,0,0,1,0|3,0,0]=4 1319 B8R1.18 Cc1sc(c(n1)C)N 1P01BJU5 [0,0,0,0,1,0|3,0,0]=4 1320 B8R1.18 Clc1[nH]c(c(n1)C)C 1P00HAX4 [0,0,0,0,1,0|3,0,0]=4 1321 B8R1.18 Cn1c(Br)cc(=O)[nH]1 1P023Z9G [0,0,0,0,1,0|2,1,0]=4 1322 B8R1.18 Cn1c(N)cc(=O)[nH]1 1P00DNDS [0,0,0,0,1,0|3,0,0]=4 1323 B8R1.18 Cn1cc(c(n1)F)N 1P0288AB [0,0,0,0,1,0|3,0,0]=4 1324 B8R1.18 Cn1cc(c(n1)F)N 1P028KE8 [0,0,0,0,1,0|3,0,0]=4 1325 B8R1.18 Ic1[nH]c(c(c1)I)I 1P01DTDK [0,0,0,0,1,0|2,1,0]=4 1326 B8R1.18 Ic1[nH]c(c(n1)C)I 1P001M8W [0,0,0,0,1,0|3,0,0]=4 1327 B8R1.18 Ic1[nH]c(c(n1)I)I 1P00209P [0,0,0,0,1,0|2,1,0]=4 1328 B8R1.18 Nc1[nH]c(c(n1)C)C 1P0018DI [0,0,0,0,1,0|3,0,0]=4 1329 B8R1.18 Nc1[nH]c(c(n1)C)C 1P00AKKE [0,0,0,0,1,0|3,0,0]=4 1330 B8R1.18 Nc1ns(=O)nc1N 1P01EKJ7 [0,0,0,0,1,0|2,0,1]=4 1331 B8R1.18 O=C1C=C(C(=O)N1)C 1P009RCV [0,0,0,0,1,0|2,0,0]=3 1332 B8R1.18 O=C1C=C(C(=O)O1)Br 1P00ED1C [0,0,0,0,1,0|2,1,0]=4 1333 B8R1.18 O=C1C=C(C(=O)O1)C 1P003530 [0,0,0,0,1,0|3,0,0]=4 1334 B8R1.18 O=C1C=C(C(N1)O)C 1P01EMD7 [0,0,0,0,1,0|2,0,1]=4 1335 B8R1.18 O=C1N=C(C(N1)C)N 1P01BAXV [0,0,0,0,1,0|2,0,1]=4 1336 B8R1.18 O=C1NC(=O)C(=C)N1 1P008PUS [0,0,0,0,1,0|2,0,1]=4 1337 B8R1.18 O=C1NC(=O)C(=O)N1 1P000QI4 [0,0,0,0,1,0|2,0,1]=4 1338 B8R1.18 O=c1[nH]c(c(o1)C)C 1P00J30T [0,0,0,0,1,0|3,0,0]=4 1339 B8R1.18 O=c1[nH]c(c(s1)C)C 1P01DUSE [0,0,0,0,1,0|3,0,0]=4 1340 B8R1.18 O=c1[nH]n(c(c1)C)C 1P00CVUD [0,0,0,0,1,0|3,0,0]=4 1341 B8R1.18 O=c1[nH]n(c(c1)C)C 1P01FMB6 [0,0,0,0,1,0|3,0,0]=4 1342 B8R1.50 Brc1noc(c1N)C 1P028NDA [0,0,0,0,1,0|3,0,0]=4 1343 B8R1.50 Brc1noc(c1N)C 1P028RUF [0,0,0,0,1,0|3,0,0]=4 1344 B8R1.50 Cc1[nH][nH]c(=O)c1N 1P01C52N [0,0,0,0,1,0|2,0,1]=4 1345 B8R1.50 Cc1[nH]nc(c1N)C 1P0037T1 [0,0,0,0,1,0|3,0,0]=4 1346 B8R1.50 Cc1[nH]nc(c1N)C 1P01EIJ0 [0,0,0,0,1,0|3,0,0]=4 1347 B8R1.50 Cc1cnn(c1N)C 1P00C9D7 [0,0,0,0,1,0|3,0,0]=4 1348 B8R1.50 Cc1cnn(c1N)C 1P01B35G [0,0,0,0,1,0|3,0,0]=4 1349 B8R1.50 Cc1csc(c1N)Cl 1P01B5VI [0,0,0,0,1,0|3,0,0]=4 1350 B8R1.50 Cc1n[nH]c(c1N)Cl 1P00HBA4 [0,0,0,0,1,0|2,1,0]=4 1351 B8R1.50 Cc1n[nH]c(c1N)N 1P00J244 [0,0,0,0,1,0|3,0,0]=4 1352 B8R1.50 Cc1n[nH]c(c1N)N 1P00J3MR [0,0,0,0,1,0|3,0,0]=4 1353 B8R1.50 Cc1nsc(c1N)Br 1P028AIL [0,0,0,0,1,0|2,1,0]=4 1354 B8R1.50 Cn1cnc(c1N)C 1P0034N6 [0,0,0,0,1,0|3,0,0]=4 1355 B8R1.50 Cn1ncc(c1Br)F 1P01B8MF [0,0,0,0,1,0|3,0,0]=4 1356 B8R1.50 Cn1ncc(c1N)Br 1P003LBP [0,0,0,0,1,0|2,1,0]=4 1357 B8R1.50 Cn1ncc(c1N)Br 1P01C2CT [0,0,0,0,1,0|2,1,0]=4 1358 B8R1.50 Cn1ncc(c1N)Br 1P01C3SQ [0,0,0,0,1,0|2,1,0]=4 1359 B8R1.50 Cn1ncc(c1N)Cl 1P00HB5B [0,0,0,0,1,0|2,1,0]=4 1360 B8R1.50 Cn1ncc(c1N)Cl 1P02844T [0,0,0,0,1,0|2,1,0]=4 1361 B8R1.50 Cn1ncc(c1N)F 1P01C44P [0,0,0,0,1,0|2,0,0]=3 1362 B8R1.50 Cn1ncc(c1N)F 1P020MEJ [0,0,0,0,1,0|2,0,0]=3 1363 B8R1.50 Cn1ncc(c1N)I 1P00ANOO [0,0,0,0,1,0|2,1,0]=4 1364 B8R1.50 Nc1c(C)csc1C 1P01DU3J [0,0,0,0,1,0|3,0,0]=4 1365 B8R1.50 Nc1c(C)noc1C 1P003J5M [0,0,0,0,1,0|3,0,0]=4 1366 B8R1.50 Nc1c(C)nsc1C 1P01BCXK [0,0,0,0,1,0|3,0,0]=4 1367 B8R1.50 Nc1c(N)cnn1C 1P002DAU [0,0,0,0,1,0|3,0,0]=4 1368 B8R1.50 Nc1c(N)cnn1C 1P01E93G [0,0,0,0,1,0|3,0,0]=4 1369 B7R0.6 NC(=O)\C=C/C(=O)N 1P003RW6 [1,0,1,0,0,0|2,0,0]=4 1370 B7R0.6 NC(=O)\C=C\C(=O)N 1P003R5Q [1,0,1,0,0,0|2,0,0]=4 1371 B7R0.2 CC(=O)NC(=O)C=C 1P01PN21 [1,0,1,0,0,0|2,0,0]=4 1372 B7R0.2 NC(=O)NC(=O)C=C 1P002AY6 [1,0,1,0,0,0|1,0,1]=4 1373 B7R1.3 Brc1ccccn1 1P0033NM [2,0,0,0,0,0|2,0,0]=4 1374 B7R1.3 Brc1cccnc1 1P00343S [2,0,0,0,0,0|1,1,0]=4 1375 B7R1.3 Brc1ccncc1 1P0034FC [2,0,0,0,0,0|2,0,0]=4 1376 B7R1.3 Brc1ccncc1 1P0038SJ [2,0,0,0,0,0|2,0,0]=4 1377 B7R1.3 Brc1ccncc1 1P00FDJY [2,0,0,0,0,0|2,0,0]=4 1378 B7R1.3 Brc1ccncn1 1P0039MI [2,0,0,0,0,0|1,0,1]=4 1379 B7R1.3 Brc1cncnc1 1P0034P7 [2,0,0,0,0,0|0,1,1]=4 1380 B7R1.3 Brc1ncccn1 1P00I90J [2,0,0,0,0,0|1,0,1]=4 1381 B7R1.3 C1CC=NC(=O)N1 1P023TVL [2,0,0,0,0,0|0,0,2]=4 1382 B7R1.3 Cc1ccccn1 1P0023GU [2,0,0,0,0,0|2,0,0]=4 1383 B7R1.3 Cc1ccccn1 1P0037Z6 [2,0,0,0,0,0|2,0,0]=4 1384 B7R1.3 Cc1cccnc1 1P003486 [2,0,0,0,0,0|2,0,0]=4 1385 B7R1.3 Cc1ccncn1 1P003M9B [2,0,0,0,0,0|1,0,1]=4 1386 B7R1.3 Cc1cncnc1 1P0029HT [2,0,0,0,0,0|1,0,1]=4 1387 B7R1.3 Cc1ncccn1 1P003I70 [2,0,0,0,0,0|1,0,1]=4 1388 B7R1.3 Clc1cccnc1 1P003JSA [2,0,0,0,0,0|1,1,0]=4 1389 B7R1.3 Clc1ccncc1 1P0034H0 [2,0,0,0,0,0|2,0,0]=4 1390 B7R1.3 Clc1ccncc1 1P003ACI [2,0,0,0,0,0|2,0,0]=4 1391 B7R1.3 Clc1ccncn1 1P00276O [2,0,0,0,0,0|1,0,1]=4 1392 B7R1.3 Clc1ccncn1 1P0029FC [2,0,0,0,0,0|1,0,1]=4 1393 B7R1.3 Clc1ccncn1 1P0038PQ [2,0,0,0,0,0|1,0,1]=4 1394 B7R1.3 Clc1cncnc1 1P007DV6 [2,0,0,0,0,0|0,1,1]=4 1395 B7R1.3 Clc1ncccn1 1P0033QC [2,0,0,0,0,0|1,0,1]=4 1396 B7R1.3 Fc1ccccc1 1P0035E9 [2,0,0,0,0,0|2,0,0]=4 1397 B7R1.3 Fc1ccccn1 1P0033SI [2,0,0,0,0,0|2,0,0]=4 1398 B7R1.3 Fc1cccnc1 1P003JYE [2,0,0,0,0,0|1,0,0]=3 1399 B7R1.3 Fc1ccncc1 1P0034IB [2,0,0,0,0,0|2,0,0]=4 1400 B7R1.3 Fc1cnccn1 1P00D9L3 [2,0,0,0,0,0|2,0,0]=4 1401 B7R1.3 Fc1cncnc1 1P0060KF [2,0,0,0,0,0|0,0,1]=3 1402 B7R1.3 Fc1ncccn1 1P00I6G6 [2,0,0,0,0,0|1,0,1]=4 1403 B7R1.3 Ic1ccccn1 1P0036MH [2,0,0,0,0,0|2,0,0]=4 1404 B7R1.3 Ic1cccnc1 1P003476 [2,0,0,0,0,0|1,1,0]=4 1405 B7R1.3 Ic1ccncc1 1P001QR9 [2,0,0,0,0,0|2,0,0]=4 1406 B7R1.3 Ic1ccncn1 1P00CLGQ [2,0,0,0,0,0|1,0,1]=4 1407 B7R1.3 Ic1cncnc1 1P0037VD [2,0,0,0,0,0|0,1,1]=4 1408 B7R1.3 Ic1ncccn1 1P00C7DI [2,0,0,0,0,0|1,0,1]=4 1409 B7R1.3 N[13c]1[13cH][13cH][13cH][13cH][13cH]1 1P0003HD [2,0,0,0,0,0|2,0,0]=4 1410 B7R1.3 Nc1ccccc1 1P003OD2 [2,0,0,0,0,0|2,0,0]=4 1411 B7R1.3 Nc1ccccc1 1P003OD4 [2,0,0,0,0,0|2,0,0]=4 1412 B7R1.3 Nc1ccccc1 1P003OD5 [2,0,0,0,0,0|2,0,0]=4 1413 B7R1.3 Nc1ccccc1 1P00DANN [2,0,0,0,0,0|2,0,0]=4 1414 B7R1.3 Nc1ccccn1 1P00CMJB [2,0,0,0,0,0|1,0,1]=4 1415 B7R1.3 Nc1cccnc1 1P003JEQ [2,0,0,0,0,0|2,0,0]=4 1416 B7R1.3 Nc1ccncc1 1P0039PA [2,0,0,0,0,0|1,0,0]=3 1417 B7R1.3 Nc1ccncn1 1P00IAZ2 [2,0,0,0,0,0|0,0,1]=3 1418 B7R1.3 Nc1ccnnc1 1P001CGL [2,0,0,0,0,0|2,0,0]=4 1419 B7R1.3 Nc1ccnnc1 1P002JIJ [2,0,0,0,0,0|2,0,0]=4 1420 B7R1.3 Nc1cncnc1 1P0034NO [2,0,0,0,0,0|1,0,1]=4 1421 B7R1.3 Nc1cnncn1 1P0050GR [2,0,0,0,0,0|1,0,1]=4 1422 B7R1.3 Nc1ncccn1 1P0033L4 [2,0,0,0,0,0|1,0,1]=4 1423 B7R1.3 Nc1ncncn1 1P00BYVN [2,0,0,0,0,0|1,0,1]=4 1424 B7R1.3 O=C1CCC=CN1 1P01BJJF [2,0,0,0,0,0|1,0,1]=4 1425 B7R1.3 O=c1cccc[nH]1 1P00HWQR [2,0,0,0,0,0|1,0,0]=3 1426 B7R1.3 O=c1cccco1 1P003O98 [2,0,0,0,0,0|2,0,0]=4 1427 B7R1.3 O=c1ccnc[nH]1 1P003967 [2,0,0,0,0,0|1,0,0]=3 1428 B7R1.3 O=c1cncc[nH]1 1P003HWP [2,0,0,0,0,0|2,0,0]=4 1429 B7R1.3 Oc1ccccn1 1P003UF8 [2,0,0,0,0,0|1,0,1]=4 1430 B7R1.3 Oc1ccccn1 1P003UIP [2,0,0,0,0,0|1,0,1]=4 1431 B7R1.3 Oc1cccnc1 1P003K1M [2,0,0,0,0,0|2,0,0]=4 1432 B7R1.3 Oc1ccncc1 1P0034J8 [2,0,0,0,0,0|2,0,0]=4 1433 B7R1.3 Oc1ccncn1 1P003M0J [2,0,0,0,0,0|1,0,1]=4 1434 B7R1.3 Oc1cncnc1 1P002TRI [2,0,0,0,0,0|1,0,1]=4 1435 B7R1.3 Oc1ncccn1 1P003HWR [2,0,0,0,0,0|0,0,2]=4 1436 B7R1.3 Oc1ncccn1 1P00DGHM [2,0,0,0,0,0|0,0,2]=4 1437 B7R1.3 S=c1cccc[nH]1 1P002TDH [2,0,0,0,0,0|1,1,0]=4 1438 B7R1.3 S=c1ccnc[nH]1 1P001KWU [2,0,0,0,0,0|1,0,0]=3 1439 B7R1.3 S=c1nccc[nH]1 1P001KWV [2,0,0,0,0,0|0,1,0]=3 1440 B7R1.3 Sc1cccnc1 1P001SU2 [2,0,0,0,0,0|2,0,0]=4 1441 B7R1.3 Sc1ccncc1 1P003MH8 [2,0,0,0,0,0|2,0,0]=4 1442 B7R1.3 Sc1ncccn1 1P000W8T [2,0,0,0,0,0|0,1,1]=4 1443 B7R1.3 [15NH2]c1ccccc1 1P00FDEF [2,0,0,0,0,0|2,0,0]=4 1444 B7R1.3 [O]c1cncnc1 1P002VWK [2,0,0,0,0,0|1,0,1]=4 1445 B9R1.1 BrCc1ccc(cn1)F 1P01BE31 [1,1,0,0,0,0|2,0,0]=4 1446 B9R1.1 BrCc1ncc(cn1)F 1P01AMTG [1,1,0,0,0,0|1,0,1]=4 1447 B9R1.1 C#Cc1ccc(=O)[nH]c1 1P000PTL [1,1,0,0,0,0|2,0,0]=4 1448 B9R1.1 C#Cc1ccc(cn1)F 1P004HS2 [1,1,0,0,0,0|2,0,0]=4 1449 B9R1.1 CN=c1ccc(c[nH]1)F 1P00IEPB [1,1,0,0,0,0|2,0,0]=4 1450 B9R1.1 CN=c1ncc(c[nH]1)Cl 1P00E3SL [1,1,0,0,0,0|1,1,0]=4 1451 B9R1.1 CNc1ncc(cn1)F 1P001U5K [1,1,0,0,0,0|1,0,1]=4 1452 B9R1.1 COc1ccc(=O)[nH]c1 1P00EF6N [1,1,0,0,0,0|2,0,0]=4 1453 B9R1.1 COc1ccc(cn1)F 1P003N7M [1,1,0,0,0,0|1,0,1]=4 1454 B9R1.1 COc1ncc(cn1)F 1P00AMWK [1,1,0,0,0,0|0,0,2]=4 1455 B9R1.1 CSc1ncc(cn1)F 1P00EDR1 [1,1,0,0,0,0|0,1,1]=4 1456 B9R1.1 ClCc1ccc(cn1)F 1P003AH4 [1,1,0,0,0,0|2,0,0]=4 1457 B9R1.1 ClCc1ccc(cn1)F 1P01AD1L [1,1,0,0,0,0|2,0,0]=4 1458 B9R1.1 ClCc1ncc(cn1)F 1P000PR4 [1,1,0,0,0,0|1,0,1]=4 1459 B9R1.1 FCc1ccc(nc1)F 1P028KGL [1,1,0,0,0,0|2,0,0]=4 1460 B9R1.1 N#Cc1ccc(=O)[nH]c1 1P003781 [1,1,0,0,0,0|2,0,0]=4 1461 B9R1.1 N#Cc1ccc(cn1)F 1P00BZEG [1,1,0,0,0,0|2,0,0]=4 1462 B9R1.1 N#Cc1ncc(cn1)F 1P003HKT [1,1,0,0,0,0|1,0,1]=4 1463 B9R1.1 NCc1ccc(=O)[nH]c1 1P003MNG [1,1,0,0,0,0|2,0,0]=4 1464 B9R1.1 NCc1ccc(cn1)F 1P003FFL [1,1,0,0,0,0|2,0,0]=4 1465 B9R1.1 NCc1ncc(cn1)F 1P000WN1 [1,1,0,0,0,0|1,0,1]=4 1466 B9R1.1 NN=c1ncc(c[nH]1)F 1P009QIB [1,1,0,0,0,0|1,0,0]=3 1467 B9R1.1 NN=c1ncc(c[nH]1)I 1P01JF5H [1,1,0,0,0,0|1,1,0]=4 1468 B9R1.1 NNc1ccc(cn1)F 1P001DZV [1,1,0,0,0,0|2,0,0]=4 1469 B9R1.1 NNc1ccc(cn1)F 1P009X08 [1,1,0,0,0,0|2,0,0]=4 1470 B9R1.1 O=Cc1ccc(=O)[nH]c1 1P0033T4 [1,1,0,0,0,0|2,0,0]=4 1471 B9R1.1 O=Cc1ccc(cc1)F 1P0034HX [1,1,0,0,0,0|2,0,0]=4 1472 B9R1.1 O=Cc1ccc(cn1)Br 1P003N1J [1,1,0,0,0,0|1,1,0]=4 1473 B9R1.1 O=Cc1ccc(cn1)C 1P0037VI [1,1,0,0,0,0|2,0,0]=4 1474 B9R1.1 O=Cc1ccc(cn1)Cl 1P0034PX [1,1,0,0,0,0|1,1,0]=4 1475 B9R1.1 O=Cc1ccc(cn1)F 1P0036BB [1,1,0,0,0,0|1,0,0]=3 1476 B9R1.1 O=Cc1ccc(cn1)N 1P0095PU [1,1,0,0,0,0|2,0,0]=4 1477 B9R1.1 O=Cc1ccc(cn1)O 1P00BFVO [1,1,0,0,0,0|2,0,0]=4 1478 B9R1.1 O=Cc1cnc(=O)[nH]c1 1P001XEL [1,1,0,0,0,0|1,0,0]=3 1479 B9R1.1 O=Cc1ncc(cn1)Br 1P0038ZF [1,1,0,0,0,0|0,1,1]=4 1480 B9R1.1 O=Cc1ncc(cn1)C 1P006H5A [1,1,0,0,0,0|1,0,1]=4 1481 B9R1.1 O=Cc1ncc(cn1)Cl 1P00IIPH [1,1,0,0,0,0|0,1,1]=4 1482 B9R1.1 O=Cc1ncc(cn1)F 1P00II4R [1,1,0,0,0,0|0,0,1]=3 1483 B9R1.1 OCc1ccc(=O)[nH]c1 1P007U3P [1,1,0,0,0,0|2,0,0]=4 1484 B9R1.1 OCc1ccc(cn1)F 1P005O1X [1,1,0,0,0,0|1,0,1]=4 1485 B9R1.1 OCc1ncc(cn1)F 1P000JRN [1,1,0,0,0,0|0,0,2]=4 1486 B9R1.2 Brc1cc(C=O)ncc1 1P00104V [1,1,0,0,0,0|2,0,0]=4 1487 B9R1.2 C#Cc1cccc(=O)[nH]1 1P01XDSA [1,1,0,0,0,0|2,0,0]=4 1488 B9R1.2 CCc1cc(N)ccn1 1P00DGSU [1,1,0,0,0,0|2,0,0]=4 1489 B9R1.2 CNc1cc(N)ccn1 1P009X0L [1,1,0,0,0,0|2,0,0]=4 1490 B9R1.2 CNc1cc[nH]c(=O)n1 1P01AG09 [1,1,0,0,0,0|0,0,2]=4 1491 B9R1.2 CNc1ccnc(c1)Br 1P00G9FU [1,1,0,0,0,0|2,0,0]=4 1492 B9R1.2 CNc1ccnc(c1)Br 1P028RRH [1,1,0,0,0,0|2,0,0]=4 1493 B9R1.2 CNc1ccnc(c1)F 1P01KKLM [1,1,0,0,0,0|2,0,0]=4 1494 B9R1.2 CNc1ccnc(n1)Br 1P01KKQM [1,1,0,0,0,0|1,0,1]=4 1495 B9R1.2 CNc1ccnc(n1)C 1P00D1QH [1,1,0,0,0,0|1,0,1]=4 1496 B9R1.2 CNc1ccnc(n1)Cl 1P00FB90 [1,1,0,0,0,0|1,0,1]=4 1497 B9R1.2 CNc1nc(N)ccn1 1P00C1RI [1,1,0,0,0,0|1,0,1]=4 1498 B9R1.2 COc1cc(N)ccn1 1P0034CU [1,1,0,0,0,0|1,0,1]=4 1499 B9R1.2 COc1cccc(=O)[nH]1 1P00BEPL [1,1,0,0,0,0|2,0,0]=4 1500 B9R1.2 COc1nc(N)ccn1 1P00C823 [1,1,0,0,0,0|0,0,2]=4 1501 B9R1.2 COc1nccc(=O)[nH]1 1P006VNT [1,1,0,0,0,0|1,0,1]=4 1502 B9R1.2 CSc1cc(N)ccn1 1P003L4L [1,1,0,0,0,0|1,1,0]=4 1503 B9R1.2 CSc1cc(N)ccn1 1P01BV4Y [1,1,0,0,0,0|1,1,0]=4 1504 B9R1.2 CSc1nc(N)ccn1 1P006ZL8 [1,1,0,0,0,0|0,1,1]=4 1505 B9R1.2 CSc1nccc(=O)[nH]1 1P003FKH [1,1,0,0,0,0|1,1,0]=4 1506 B9R1.2 Cc1cc(C=O)ncc1 1P003M99 [1,1,0,0,0,0|2,0,0]=4 1507 B9R1.2 Cc1ccnc(n1)C=O 1P00ILN9 [1,1,0,0,0,0|1,0,1]=4 1508 B9R1.2 ClCc1nccc(=O)[nH]1 1P006ARJ [1,1,0,0,0,0|2,0,0]=4 1509 B9R1.2 Clc1cc(C=O)ncc1 1P003LP1 [1,1,0,0,0,0|2,0,0]=4 1510 B9R1.2 Clc1ccnc(n1)C=O 1P01DL3X [1,1,0,0,0,0|1,0,1]=4 1511 B9R1.2 Fc1cc(C=O)ncc1 1P008ZJK [1,1,0,0,0,0|2,0,0]=4 1512 B9R1.2 NCc1cc(=O)nc[nH]1 1P02848E [1,1,0,0,0,0|2,0,0]=4 1513 B9R1.2 NCc1cc[nH]c(=O)c1 1P006BTS [1,1,0,0,0,0|1,0,1]=4 1514 B9R1.2 NCc1cc[nH]c(=O)c1 1P009I31 [1,1,0,0,0,0|1,0,1]=4 1515 B9R1.2 NCc1cc[nH]c(=O)c1 1P01JVQ8 [1,1,0,0,0,0|1,0,1]=4 1516 B9R1.2 NCc1cccc(=O)[nH]1 1P01A4RU [1,1,0,0,0,0|1,0,0]=3 1517 B9R1.2 NCc1cccc(=O)[nH]1 1P01KLL7 [1,1,0,0,0,0|1,0,0]=3 1518 B9R1.2 NCc1ccnc(c1)Br 1P004XV2 [1,1,0,0,0,0|2,0,0]=4 1519 B9R1.2 NCc1ccnc(c1)Br 1P01BW3U [1,1,0,0,0,0|2,0,0]=4 1520 B9R1.2 NCc1ccnc(c1)Br 1P01EE6S [1,1,0,0,0,0|2,0,0]=4 1521 B9R1.2 NCc1ccnc(c1)C 1P00A0HX [1,1,0,0,0,0|2,0,0]=4 1522 B9R1.2 NCc1ccnc(c1)C 1P00IILX [1,1,0,0,0,0|2,0,0]=4 1523 B9R1.2 NCc1ccnc(c1)Cl 1P001KSS [1,1,0,0,0,0|2,0,0]=4 1524 B9R1.2 NCc1ccnc(c1)Cl 1P006G2L [1,1,0,0,0,0|2,0,0]=4 1525 B9R1.2 NCc1ccnc(c1)Cl 1P01C3Q0 [1,1,0,0,0,0|2,0,0]=4 1526 B9R1.2 NCc1ccnc(c1)F 1P00FDO6 [1,1,0,0,0,0|2,0,0]=4 1527 B9R1.2 NCc1ccnc(c1)F 1P01BRHN [1,1,0,0,0,0|2,0,0]=4 1528 B9R1.2 NCc1ccnc(c1)N 1P002CH8 [1,1,0,0,0,0|2,0,0]=4 1529 B9R1.2 NCc1ccnc(c1)O 1P01A90Q [1,1,0,0,0,0|1,0,1]=4 1530 B9R1.2 NCc1ccnc(n1)C 1P00C4D0 [1,1,0,0,0,0|1,0,1]=4 1531 B9R1.2 NCc1ccnc(n1)C 1P0285AS [1,1,0,0,0,0|1,0,1]=4 1532 B9R1.2 NCc1ccnc(n1)Cl 1P00HTVQ [1,1,0,0,0,0|1,0,1]=4 1533 B9R1.2 NCc1ccnc(n1)N 1P019L2Q [1,1,0,0,0,0|1,0,1]=4 1534 B9R1.2 NCc1nccc(=O)[nH]1 1P01C58R [1,1,0,0,0,0|2,0,0]=4 1535 B9R1.2 NCc1nccc(c1)N 1P01EKJ0 [1,1,0,0,0,0|2,0,0]=4 1536 B9R1.2 NCc1nccc(n1)N 1P01A0N6 [1,1,0,0,0,0|1,0,1]=4 1537 B9R1.2 NCc1nccc(n1)N 1P024SPK [1,1,0,0,0,0|1,0,1]=4 1538 B9R1.2 NN=c1cccc([nH]1)C 1P008Y49 [1,1,0,0,0,0|2,0,0]=4 1539 B9R1.2 NNc1cc[nH]c(=O)c1 1P00957K [1,1,0,0,0,0|1,0,1]=4 1540 B9R1.2 NNc1ccnc(c1)Br 1P01ADAI [1,1,0,0,0,0|2,0,0]=4 1541 B9R1.2 NNc1ccnc(c1)C 1P00J221 [1,1,0,0,0,0|2,0,0]=4 1542 B9R1.2 NNc1ccnc(c1)C 1P01BVOB [1,1,0,0,0,0|2,0,0]=4 1543 B9R1.2 NNc1ccnc(c1)Cl 1P005GEI [1,1,0,0,0,0|2,0,0]=4 1544 B9R1.2 NNc1ccnc(c1)F 1P008ISO [1,1,0,0,0,0|2,0,0]=4 1545 B9R1.2 NNc1ccnc(n1)Cl 1P006UCE [1,1,0,0,0,0|1,0,1]=4 1546 B9R1.2 N\N=c\1/cccc([nH]1)F 1P008MLV [1,1,0,0,0,0|2,0,0]=4 1547 B9R1.2 Nc1cc(C=C)ncc1 1P0006QG [1,1,0,0,0,0|2,0,0]=4 1548 B9R1.2 Nc1cc(CO)ncc1 1P0001GT [1,1,0,0,0,0|1,0,1]=4 1549 B9R1.2 Nc1cc(CO)ncc1 1P00A3VD [1,1,0,0,0,0|1,0,1]=4 1550 B9R1.2 Nc1cc(ncc1)C#C 1P006IAF [1,1,0,0,0,0|2,0,0]=4 1551 B9R1.2 Nc1cc(ncc1)C#C 1P00HUTT [1,1,0,0,0,0|2,0,0]=4 1552 B9R1.2 Nc1cc(ncc1)C#N 1P006TZF [1,1,0,0,0,0|2,0,0]=4 1553 B9R1.2 Nc1ccnc(n1)C#N 1P002OWT [1,1,0,0,0,0|1,0,1]=4 1554 B9R1.2 Nc1ccnc(n1)CCl 1P008M4R [1,1,0,0,0,0|1,0,1]=4 1555 B9R1.2 Nc1ccnc(n1)CCl 1P01BHRC [1,1,0,0,0,0|1,0,1]=4 1556 B9R1.2 Nc1ccnc(n1)CO 1P027PA4 [1,1,0,0,0,0|0,0,2]=4 1557 B9R1.2 O=Cc1cccc(=O)[nH]1 1P00CBKE [1,1,0,0,0,0|2,0,0]=4 1558 B9R1.2 O=Cc1cccc(c1)N 1P000X9L [1,1,0,0,0,0|2,0,0]=4 1559 B9R1.2 O=Cc1cccc(n1)N 1P00CBAY [1,1,0,0,0,0|1,0,1]=4 1560 B9R1.2 OCc1cccc(=O)[nH]1 1P007ETW [1,1,0,0,0,0|2,0,0]=4 1561 B9R1.2 OCc1nccc(=O)[nH]1 1P00CYET [1,1,0,0,0,0|1,0,1]=4 1562 B9R1.2 ONc1ccnc(=O)[nH]1 1P002ANF [1,1,0,0,0,0|0,0,0]=2 1563 B9R1.3 Cc1c(N)ccnc1C 1P0017RO [1,1,0,0,0,0|2,0,0]=4 1564 B9R1.3 Clc1c(N)ccnc1Cl 1P00AKZ0 [1,1,0,0,0,0|2,0,0]=4 1565 B9R1.3 Clc1c(N)ccnc1Cl 1P02814E [1,1,0,0,0,0|2,0,0]=4 1566 B9R1.3 Cn1c(Br)cccc1=O 1P00H0NQ [1,1,0,0,0,0|2,0,0]=4 1567 B9R1.3 Cn1c(Cl)cccc1=O 1P007DNI [1,1,0,0,0,0|2,0,0]=4 1568 B9R1.3 Cn1c(N)cccc1=O 1P028SZO [1,1,0,0,0,0|1,0,0]=3 1569 B9R1.3 Cn1c(N)ccnc1=O 1P00E0LA [1,1,0,0,0,0|0,0,0]=2 1570 B9R1.3 Cn1c(N)nccc1=O 1P00BLJR [1,1,0,0,0,0|2,0,0]=4 1571 B9R1.3 Fc1c(N)ccnc1F 1P01B7XG [1,1,0,0,0,0|2,0,0]=4 1572 B9R1.3 Fc1c(N)ccnc1F 1P01BV3Y [1,1,0,0,0,0|2,0,0]=4 1573 B9R1.3 Nc1c(N)ccnc1Br 1P002IKE [1,1,0,0,0,0|2,0,0]=4 1574 B9R1.3 Nc1c(N)ccnc1C 1P001R2S [1,1,0,0,0,0|2,0,0]=4 1575 B9R1.3 Nc1c(N)ccnc1Cl 1P0076G6 [1,1,0,0,0,0|2,0,0]=4 1576 B9R1.3 Nc1c(N)ccnc1N 1P00DETR [1,1,0,0,0,0|2,0,0]=4 1577 B9R1.3 Nc1c(N)ccnc1O 1P00C7H7 [1,1,0,0,0,0|1,0,1]=4 1578 B9R1.3 Nc1cc[nH]c(=O)c1Cl 1P00DGR1 [1,1,0,0,0,0|1,0,1]=4 1579 B9R1.3 Nc1ccnc([n+]1[O-])N 1P00FAHG [1,1,0,0,0,0|1,0,1]=4 1580 B9R1.3 Nc1ccnc(c1Br)C 1P00IKGJ [1,1,0,0,0,0|2,0,0]=4 1581 B9R1.3 Nc1ccnc(c1Br)Cl 1P003L5T [1,1,0,0,0,0|2,0,0]=4 1582 B9R1.3 Nc1ccnc(c1Br)F 1P0012DC [1,1,0,0,0,0|2,0,0]=4 1583 B9R1.3 Nc1ccnc(c1C)Br 1P005CTD [1,1,0,0,0,0|2,0,0]=4 1584 B9R1.3 Nc1ccnc(c1C)Cl 1P005CTC [1,1,0,0,0,0|2,0,0]=4 1585 B9R1.3 Nc1ccnc(c1C)F 1P001BAI [1,1,0,0,0,0|2,0,0]=4 1586 B9R1.3 Nc1ccnc(c1Cl)Br 1P00EGNW [1,1,0,0,0,0|2,0,0]=4 1587 B9R1.3 Nc1ccnc(c1Cl)C 1P006B0Z [1,1,0,0,0,0|2,0,0]=4 1588 B9R1.3 Nc1ccnc(c1Cl)F 1P000JSR [1,1,0,0,0,0|2,0,0]=4 1589 B9R1.3 Nc1ccnc(c1Cl)F 1P01BW8S [1,1,0,0,0,0|2,0,0]=4 1590 B9R1.3 Nc1ccnc(c1F)Br 1P01DZ7E [1,1,0,0,0,0|2,0,0]=4 1591 B9R1.3 Nc1ccnc(c1F)C 1P001R2R [1,1,0,0,0,0|2,0,0]=4 1592 B9R1.3 Nc1ccnc(c1F)Cl 1P000JSS [1,1,0,0,0,0|2,0,0]=4 1593 B9R1.3 Nc1ccnc(c1F)Cl 1P01C2XU [1,1,0,0,0,0|2,0,0]=4 1594 B9R1.3 Nc1ccnc(c1I)Br 1P000UFK [1,1,0,0,0,0|2,0,0]=4 1595 B9R1.3 Nc1ccnc(c1I)C 1P00G65M [1,1,0,0,0,0|2,0,0]=4 1596 B9R1.3 Nc1ccnc(c1I)Cl 1P00390F [1,1,0,0,0,0|2,0,0]=4 1597 B9R1.3 Nc1ccnc(c1O)Cl 1P000JQE [1,1,0,0,0,0|2,0,0]=4 1598 B9R1.3 O=c1cc[nH]c(=O)n1C 1P00IB7O [1,1,0,0,0,0|1,0,1]=4 1599 B9R1.3 O=c1nc[nH]c(c1C)N 1P00DYD1 [1,1,0,0,0,0|2,0,0]=4 1600 B9R1.34 Brc1cc(=O)[nH]c(=O)[nH]1 1P00CRZ8 [1,1,0,0,0,0|1,0,1]=4 1601 B9R1.34 Brc1cc(C)[nH]c(=O)c1 1P00KA9J [1,1,0,0,0,0|2,0,0]=4 1602 B9R1.34 Brc1cc(F)[nH]c(=O)c1 1P009DG1 [1,1,0,0,0,0|2,0,0]=4 1603 B9R1.34 Cc1cc(=S)[nH]c(=O)[nH]1 1P00H6ZQ [1,1,0,0,0,0|1,0,1]=4 1604 B9R1.34 Cc1cc(C)[nH]c(=O)c1 1P001SOH [1,1,0,0,0,0|2,0,0]=4 1605 B9R1.34 Cc1cc(C)[nH]c(=O)n1 1P003HV1 [1,1,0,0,0,0|1,0,0]=3 1606 B9R1.34 Cc1cc(C)[nH]c(=O)n1 1P028LUT [1,1,0,0,0,0|1,0,0]=3 1607 B9R1.34 Cc1cc(C)[nH]c(=S)n1 1P003HYO [1,1,0,0,0,0|1,1,0]=4 1608 B9R1.34 Cc1cc(N)nc(n1)C 1P003GMI [1,1,0,0,0,0|1,0,1]=4 1609 B9R1.34 Cc1cc(N)nc(n1)Cl 1P001J41 [1,1,0,0,0,0|1,0,1]=4 1610 B9R1.34 Cc1cc(N)nc(n1)N 1P002793 [1,1,0,0,0,0|1,0,1]=4 1611 B9R1.34 Cc1cc(N)nc(n1)N 1P01EKIZ [1,1,0,0,0,0|1,0,1]=4 1612 B9R1.34 Cc1cc(N)nc(n1)S 1P01DNV3 [1,1,0,0,0,0|0,1,1]=4 1613 B9R1.34 Cc1cc(O)[nH]c(=O)c1 1P00I91O [1,1,0,0,0,0|2,0,0]=4 1614 B9R1.34 Cc1nc(N)[nH]c(=O)n1 1P001UN4 [1,1,0,0,0,0|1,0,0]=3 1615 B9R1.34 Clc1cc(=O)[nH]c(=O)[nH]1 1P0034TK [1,1,0,0,0,0|1,0,1]=4 1616 B9R1.34 Clc1cc(C)[nH]c(=O)c1 1P000JSV [1,1,0,0,0,0|2,0,0]=4 1617 B9R1.34 Clc1cc(Cl)[nH]c(=O)c1 1P00FF8G [1,1,0,0,0,0|2,0,0]=4 1618 B9R1.34 Clc1cc(Cl)[nH]c(=O)n1 1P00EIVZ [1,1,0,0,0,0|1,0,0]=3 1619 B9R1.34 Clc1nc(=O)[nH]c(=O)[nH]1 1P005LO1 [1,1,0,0,0,0|2,0,0]=4 1620 B9R1.34 Clc1nc(Cl)[nH]c(=O)c1 1P008ZHO [1,1,0,0,0,0|2,0,0]=4 1621 B9R1.34 Clc1nc(Cl)[nH]c(=O)n1 1P001Q9Z [1,1,0,0,0,0|2,0,0]=4 1622 B9R1.34 Ic1cc(=O)[nH]c(=O)[nH]1 1P003NPO [1,1,0,0,0,0|1,0,1]=4 1623 B9R1.34 Nc1cc(=O)[nH]c(=N)[nH]1 1P00IAGC [1,1,0,0,0,0|1,0,1]=4 1624 B9R1.34 Nc1cc(=O)[nH]c(=O)[nH]1 1P003L53 [1,1,0,0,0,0|0,0,1]=3 1625 B9R1.34 Nc1cc(=O)[nH]c(=S)[nH]1 1P0038QD [1,1,0,0,0,0|0,1,1]=4 1626 B9R1.34 Nc1cc(=O)[nH]c(=S)[nH]1 1P003L71 [1,1,0,0,0,0|0,1,1]=4 1627 B9R1.34 Nc1cc(=O)[nH]c(n1)Cl 1P003NIY [1,1,0,0,0,0|2,0,0]=4 1628 B9R1.34 Nc1cc(Br)nc(c1)Br 1P003L50 [1,1,0,0,0,0|2,0,0]=4 1629 B9R1.34 Nc1cc(Br)nc(n1)C 1P000CA3 [1,1,0,0,0,0|1,0,1]=4 1630 B9R1.34 Nc1cc(Br)nc(n1)N 1P0282JM [1,1,0,0,0,0|1,0,1]=4 1631 B9R1.34 Nc1cc(C)[nH]c(=O)n1 1P01A4RX [1,1,0,0,0,0|1,0,0]=3 1632 B9R1.34 Nc1cc(C)nc(c1)Br 1P005CTE [1,1,0,0,0,0|2,0,0]=4 1633 B9R1.34 Nc1cc(C)nc(c1)C 1P003GMG [1,1,0,0,0,0|2,0,0]=4 1634 B9R1.34 Nc1cc(C)nc(c1)Cl 1P0054E3 [1,1,0,0,0,0|2,0,0]=4 1635 B9R1.34 Nc1cc(C)nc(c1)F 1P001TEU [1,1,0,0,0,0|2,0,0]=4 1636 B9R1.34 Nc1cc(C)nc(c1)O 1P01KL0X [1,1,0,0,0,0|1,0,1]=4 1637 B9R1.34 Nc1cc(C)oc(=O)c1 1P00AI4Y [1,1,0,0,0,0|2,0,0]=4 1638 B9R1.34 Nc1cc(Cl)[nH]c(=O)c1 1P000JUK [1,1,0,0,0,0|1,0,1]=4 1639 B9R1.34 Nc1cc(Cl)[nH]c(=O)n1 1P01DWVP [1,1,0,0,0,0|1,0,0]=3 1640 B9R1.34 Nc1cc(Cl)nc(c1)Br 1P028EDV [1,1,0,0,0,0|2,0,0]=4 1641 B9R1.34 Nc1cc(Cl)nc(c1)Cl 1P0034CP [1,1,0,0,0,0|2,0,0]=4 1642 B9R1.34 Nc1cc(Cl)nc(n1)C 1P0020I7 [1,1,0,0,0,0|1,0,1]=4 1643 B9R1.34 Nc1cc(Cl)nc(n1)Cl 1P0004OU [1,1,0,0,0,0|1,0,1]=4 1644 B9R1.34 Nc1cc(Cl)nc(n1)N 1P001OVL [1,1,0,0,0,0|1,0,1]=4 1645 B9R1.34 Nc1cc(F)[nH]c(=O)c1 1P009QHV [1,1,0,0,0,0|1,0,1]=4 1646 B9R1.34 Nc1cc(F)nc(c1)F 1P00EAAA [1,1,0,0,0,0|2,0,0]=4 1647 B9R1.34 Nc1cc(F)nc(n1)C 1P00B6TT [1,1,0,0,0,0|1,0,1]=4 1648 B9R1.34 Nc1cc(F)nc(n1)F 1P006FXD [1,1,0,0,0,0|1,0,1]=4 1649 B9R1.34 Nc1cc(F)nc(n1)N 1P005JMX [1,1,0,0,0,0|1,0,1]=4 1650 B9R1.34 Nc1cc(I)nc(n1)C 1P005ZOM [1,1,0,0,0,0|1,0,1]=4 1651 B9R1.34 Nc1cc(I)nc(n1)N 1P00FGIN [1,1,0,0,0,0|1,0,1]=4 1652 B9R1.34 Nc1cc(N)[nH]c(=O)n1 1P01KLD3 [1,1,0,0,0,0|0,0,0]=2 1653 B9R1.34 Nc1cc(N)[nH]c(=S)n1 1P0002DL [1,1,0,0,0,0|0,1,0]=3 1654 B9R1.34 Nc1cc(N)nc(c1)Cl 1P01FJ5V [1,1,0,0,0,0|2,0,0]=4 1655 B9R1.34 Nc1cc(N)nc(n1)C 1P002B3J [1,1,0,0,0,0|1,0,1]=4 1656 B9R1.34 Nc1cc(N)nc(n1)C 1P028Q8D [1,1,0,0,0,0|1,0,1]=4 1657 B9R1.34 Nc1cc(N)nc(n1)Cl 1P00DKVT [1,1,0,0,0,0|1,0,1]=4 1658 B9R1.34 Nc1cc(N)nc(n1)N 1P0002DM [1,1,0,0,0,0|1,0,1]=4 1659 B9R1.34 Nc1cc(O)nc(n1)C 1P003L72 [1,1,0,0,0,0|1,0,1]=4 1660 B9R1.34 Nc1cc(O)nc(n1)C 1P008PX1 [1,1,0,0,0,0|1,0,1]=4 1661 B9R1.34 Nc1cc(O)nc(n1)C 1P00IMT3 [1,1,0,0,0,0|1,0,1]=4 1662 B9R1.34 Nc1cc(O)nc(n1)N 1P00030Z [1,1,0,0,0,0|1,0,1]=4 1663 B9R1.34 Nc1nc(N)[nH]c(=O)c1 1P00AI9E [1,1,0,0,0,0|2,0,0]=4 1664 B9R1.34 Nc1nc(N)[nH]c(=S)c1 1P0031LJ [1,1,0,0,0,0|2,0,0]=4 1665 B9R1.34 O=C1CC(=CC(=O)N1)N 1P00B2G5 [1,1,0,0,0,0|1,0,1]=4 1666 B9R1.34 O=C1CC(=CC(=O)N1)O 1P01AKQQ [1,1,0,0,0,0|2,0,0]=4 1667 B9R1.34 O=C1CC(=NC(=O)N1)[O-] 1P00DA71 [1,1,0,0,0,0|1,0,1]=4 1668 B9R1.34 O=C1CC(=O)N=C(N1)N 1P00K2ZF [1,1,0,0,0,0|2,0,0]=4 1669 B9R1.34 O=c1cc(Cl)[nH]c(n1)C 1P0021H6 [1,1,0,0,0,0|2,0,0]=4 1670 B9R1.34 O=c1cc(Cl)[nH]c(n1)N 1P000J5I [1,1,0,0,0,0|2,0,0]=4 1671 B9R1.34 O=c1cc(O)[nH]c(n1)C 1P000J5H [1,1,0,0,0,0|2,0,0]=4 1672 B9R1.34 OC1=CC(=NC(=O)C1)C 1P001QHF [1,1,0,0,0,0|2,0,0]=4 1673 B9R1.34 Oc1cc(=O)[nH]c(n1)N 1P003GVC [1,1,0,0,0,0|2,0,0]=4 1674 B9R1.34 Oc1cc(C)[nH]c(=O)c1 1P0033G4 [1,1,0,0,0,0|2,0,0]=4 1675 B9R1.15 BrCc1ccncc1F 1P024V4W [1,1,0,0,0,0|2,0,0]=4 1676 B9R1.15 C#Cc1ccncc1F 1P01B9QZ [1,1,0,0,0,0|2,0,0]=4 1677 B9R1.15 C#Cc1cnccc1N 1P01FPD6 [1,1,0,0,0,0|2,0,0]=4 1678 B9R1.15 CCc1ccncc1F 1P0013FK [1,1,0,0,0,0|2,0,0]=4 1679 B9R1.15 CCc1ncncc1F 1P0013GL [1,1,0,0,0,0|1,0,1]=4 1680 B9R1.15 CNc1ccccc1F 1P002BI4 [1,1,0,0,0,0|2,0,0]=4 1681 B9R1.15 CNc1ccncc1Br 1P00G8MG [1,1,0,0,0,0|1,1,0]=4 1682 B9R1.15 CNc1ccncc1C 1P01BE54 [1,1,0,0,0,0|2,0,0]=4 1683 B9R1.15 CNc1ccncc1I 1P00G2A7 [1,1,0,0,0,0|1,1,0]=4 1684 B9R1.15 CNc1ccncc1N 1P028Q65 [1,1,0,0,0,0|2,0,0]=4 1685 B9R1.15 CNc1cnccc1N 1P00B4SE [1,1,0,0,0,0|2,0,0]=4 1686 B9R1.15 CNc1ncccc1F 1P00BJFB [1,1,0,0,0,0|1,0,1]=4 1687 B9R1.15 CNc1ncncc1F 1P01BCYC [1,1,0,0,0,0|0,0,1]=3 1688 B9R1.15 CNc1ncncc1I 1P01BHFH [1,1,0,0,0,0|0,1,1]=4 1689 B9R1.15 CNc1ncncc1N 1P00AK2S [1,1,0,0,0,0|1,0,1]=4 1690 B9R1.15 COc1ccncc1F 1P0084WY [1,1,0,0,0,0|2,0,0]=4 1691 B9R1.15 COc1cnccc1N 1P00DBRZ [1,1,0,0,0,0|2,0,0]=4 1692 B9R1.15 COc1cncnc1N 1P005WSA [1,1,0,0,0,0|1,0,1]=4 1693 B9R1.15 COc1ncncc1F 1P008Z73 [1,1,0,0,0,0|1,0,1]=4 1694 B9R1.15 CSc1cnccc1N 1P01DL3L [1,1,0,0,0,0|2,0,0]=4 1695 B9R1.15 ClCc1ccncc1F 1P00958P [1,1,0,0,0,0|2,0,0]=4 1696 B9R1.15 ClCc1ccncc1F 1P00HUT4 [1,1,0,0,0,0|2,0,0]=4 1697 B9R1.15 N#Cc1ccncc1F 1P000A3A [1,1,0,0,0,0|1,0,1]=4 1698 B9R1.15 N#Cc1cnccc1N 1P001QK6 [1,1,0,0,0,0|2,0,0]=4 1699 B9R1.15 N#Cc1cncnc1N 1P001UPC [1,1,0,0,0,0|1,0,1]=4 1700 B9R1.15 NCc1ccccc1F 1P0033SE [1,1,0,0,0,0|2,0,0]=4 1701 B9R1.15 NCc1ccncc1Br 1P004CWE [1,1,0,0,0,0|1,1,0]=4 1702 B9R1.15 NCc1ccncc1Br 1P01C11A [1,1,0,0,0,0|1,1,0]=4 1703 B9R1.15 NCc1ccncc1Br 1P01EDYH [1,1,0,0,0,0|1,1,0]=4 1704 B9R1.15 NCc1ccncc1C 1P00665P [1,1,0,0,0,0|2,0,0]=4 1705 B9R1.15 NCc1ccncc1C 1P00IE0H [1,1,0,0,0,0|2,0,0]=4 1706 B9R1.15 NCc1ccncc1Cl 1P00H1FA [1,1,0,0,0,0|1,1,0]=4 1707 B9R1.15 NCc1ccncc1Cl 1P00HHLV [1,1,0,0,0,0|1,1,0]=4 1708 B9R1.15 NCc1ccncc1F 1P008EEF [1,1,0,0,0,0|1,0,0]=3 1709 B9R1.15 NCc1ccncc1F 1P00A0HY [1,1,0,0,0,0|1,0,0]=3 1710 B9R1.15 NCc1ccncc1N 1P001JPK [1,1,0,0,0,0|2,0,0]=4 1711 B9R1.15 NCc1ccncc1O 1P002A71 [1,1,0,0,0,0|2,0,0]=4 1712 B9R1.15 NCc1cnccc1N 1P01AGC1 [1,1,0,0,0,0|2,0,0]=4 1713 B9R1.15 NCc1cncnc1N 1P01A1P3 [1,1,0,0,0,0|1,0,1]=4 1714 B9R1.15 NCc1cncnc1N 1P024TUQ [1,1,0,0,0,0|1,0,1]=4 1715 B9R1.15 NCc1ncccc1F 1P000S1P [1,1,0,0,0,0|1,0,1]=4 1716 B9R1.15 NCc1ncccc1F 1P0039LA [1,1,0,0,0,0|1,0,1]=4 1717 B9R1.15 NCc1ncccc1F 1P00CBG3 [1,1,0,0,0,0|1,0,1]=4 1718 B9R1.15 NNc1ccccc1F 1P002OLG [1,1,0,0,0,0|2,0,0]=4 1719 B9R1.15 NNc1ccccc1F 1P002YAI [1,1,0,0,0,0|2,0,0]=4 1720 B9R1.15 NNc1ccncc1Br 1P00IN68 [1,1,0,0,0,0|1,1,0]=4 1721 B9R1.15 NNc1ccncc1C 1P008VKW [1,1,0,0,0,0|2,0,0]=4 1722 B9R1.15 NNc1ccncc1C 1P01X5LC [1,1,0,0,0,0|2,0,0]=4 1723 B9R1.15 NNc1ccncc1Cl 1P019ZC5 [1,1,0,0,0,0|1,1,0]=4 1724 B9R1.15 NNc1ccncc1F 1P01B5SR [1,1,0,0,0,0|1,0,0]=3 1725 B9R1.15 NNc1ncccc1F 1P0036QS [1,1,0,0,0,0|1,0,1]=4 1726 B9R1.15 NNc1ncncc1Cl 1P00AI8U [1,1,0,0,0,0|0,1,1]=4 1727 B9R1.15 NOc1ccccc1F 1P01BFN6 [1,1,0,0,0,0|2,0,0]=4 1728 B9R1.15 O=Cc1ccncc1F 1P003463 [1,1,0,0,0,0|2,0,0]=4 1729 B9R1.15 O=Cc1cnccc1N 1P0037OR [1,1,0,0,0,0|2,0,0]=4 1730 B9R1.15 O=Cc1cnccc1N 1P00619R [1,1,0,0,0,0|2,0,0]=4 1731 B9R1.15 O=Cc1cncnc1N 1P001UPA [1,1,0,0,0,0|1,0,1]=4 1732 B9R1.15 OCc1ccncc1F 1P008EEG [1,1,0,0,0,0|2,0,0]=4 1733 B9R1.15 OCc1cnccc1N 1P0018HB [1,1,0,0,0,0|2,0,0]=4 1734 B9R1.15 OCc1cncnc1N 1P00558M [1,1,0,0,0,0|1,0,1]=4 1735 B9R1.23 O=Cc1[nH]c(c(c1)Br)Br 1P00GSFD [0,1,0,0,1,0|1,1,0]=4 1736 B9R1.23 O=Cc1[nH]c(c(n1)C)C 1P0076T6 [0,1,0,0,1,0|2,0,0]=4 1737 B9R1.37 BrC1=CC(=O)N(C1=O)C 1P019SNO [0,1,0,0,1,0|1,1,0]=4 1738 B9R1.37 CC1=CC(=O)N(C1=O)C 1P019XL5 [0,1,0,0,1,0|2,0,0]=4 1739 B9R1.37 Cc1nc(c(n1C)N)C 1P0293PL [0,1,0,0,1,0|2,0,0]=4 1740 B9R1.37 O=C1NC(=O)C(=C1Br)Br 1P007UIT [0,1,0,0,1,0|1,1,0]=4 1741 B9R1.37 O=C1NC(=O)C(=C1C)C 1P0026BX [0,1,0,0,1,0|2,0,0]=4 1742 B9R1.37 O=C1NC(=O)C(=C1Cl)Cl 1P009OA0 [0,1,0,0,1,0|1,1,0]=4 1743 B11R1.8 NNc1cc(F)nc(c1F)F 1P01DX69 [0,2,0,0,0,0|2,0,0]=4 1744 B11R1.14 ClCc1nc(C)c(c(=O)[nH]1)F 1P027VG1 [0,2,0,0,0,0|2,0,0]=4 1745 B11R1.32 Clc1nc(Cl)c(c(c1F)N)F 1P01ELL5 [0,2,0,0,0,0|2,0,0]=4 1746 B11R1.32 Fc1c(F)nc(c(c1N)Cl)F 1P003JN6 [0,2,0,0,0,0|2,0,0]=4 1747 B11R1.32 Fc1nc(F)c(c(c1F)N)F 1P001YDG [0,2,0,0,0,0|2,0,0]=4 1748 B11R1.32 O=c1[nH]c(=O)c(c(n1C)N)Br 1P001G5G [0,2,0,0,0,0|0,1,1]=4 1749 B11R1.32 O=c1[nH]c(=O)c(c(n1C)N)N 1P0068I7 [0,2,0,0,0,0|1,0,1]=4 1750 B11R1.32 O=c1[nH]c(=O)c(c(n1C)N)N 1P01BH36 [0,2,0,0,0,0|1,0,1]=4 1751 B11R1.32 O=c1[nH]c(=O)n(c(c1C)N)C 1P01C2TQ [0,2,0,0,0,0|1,0,1]=4 1752 B11R1.32 O=c1n(C)cc(c(=O)n1C)F 1P00BFE7 [0,2,0,0,0,0|1,0,1]=4 1753 B11R1.464 COc1c(C)nc(=O)[nH]c1C 1P027UJL [0,2,0,0,0,0|2,0,0]=4 1754 B11R1.464 Nc1c(C=O)c(=O)nc([nH]1)N 1P004F8C [0,2,0,0,0,0|2,0,0]=4 1755 B11R1.464 O=Cc1c(N)[nH]c(=O)[nH]c1=O 1P004KUI [0,2,0,0,0,0|1,0,1]=4 1756 B11R1.81 CC#Cc1cnc(=O)[nH]c1N 1P00B37L [0,2,0,0,0,0|1,0,0]=3 1757 B11R1.166 OC(=O)c1cnc(=O)[nH]c1C 1P000UGR [0,2,0,0,0,0|2,0,0]=4 1758 B11R1.166 [O-][N+](=O)c1ccc(=O)[nH]c1N 1P00BFHF [0,2,0,0,0,0|2,0,0]=4 1759 B11R1.166 [O-][N+](=O)c1cnc(=O)[nH]c1N 1P00FSOM [0,2,0,0,0,0|1,0,0]=3 1760 B11R1.278 O=Cc1ncc(c(c1F)Cl)F 1P00HUC3 [0,2,0,0,0,0|2,0,0]=4 1761 B11R1.167 Brc1ncc(c(c1)C(=O)N)F 1P01FPDF [0,2,0,0,0,0|2,0,0]=4 1762 B11R1.167 Brc1ncc(c(c1)C(N)C)F 1P0287RC [0,2,0,0,0,0|2,0,0]=4 1763 B11R1.167 CN(c1[nH]c(=O)ncc1F)C 1P00J32H [0,2,0,0,0,0|0,0,0]=2 1764 B11R1.280 COc1ncc(c(n1)NN)F 1P001X9R [0,2,0,0,0,0|0,0,2]=4 1765 B11R1.21 CC(=O)c1ccc(c(c1)N)F 1P002D2M [0,2,0,0,0,0|2,0,0]=4 1766 B11R1.21 CS(=O)c1ncc(c(n1)N)Br 1P01FIYJ [0,2,0,0,0,0|0,1,1]=4 1767 B11R1.21 FC(c1ncc(c(c1)N)F)F 1P01ENJ2 [0,2,0,0,0,0|2,0,0]=4 1768 B11R1.21 NC(=O)c1ccc(c(c1)N)F 1P00H871 [0,2,0,0,0,0|2,0,0]=4 1769 B11R1.21 OC(=O)c1ccc(c(c1)N)F 1P002OHW [0,2,0,0,0,0|2,0,0]=4 1770 B11R1.21 OC(=O)c1ncc(c(c1)C)F 1P020MOW [0,2,0,0,0,0|2,0,0]=4 1771 B11R1.21 OC(=O)c1ncc(c(c1)N)Br 1P009XXJ [0,2,0,0,0,0|1,1,0]=4 1772 B11R1.21 OC(=O)c1ncc(c(c1)N)Cl 1P028143 [0,2,0,0,0,0|1,1,0]=4 1773 B11R1.21 OC(=O)c1ncc(c(c1)N)F 1P028N1Q [0,2,0,0,0,0|1,0,0]=3 1774 B11R1.21 OC(=O)c1ncc(c(n1)Cl)F 1P027UJT [0,2,0,0,0,0|1,0,1]=4 1775 B11R1.21 [O-][N+](=O)c1ccc(c(c1)N)F 1P003HR6 [0,2,0,0,0,0|2,0,0]=4 1776 B11R1.21 [O-][N+](=O)c1ncc(c(c1)C)F 1P01KKSF [0,2,0,0,0,0|2,0,0]=4 1777 B11R1.192 CCOc1ncc(c(=O)[nH]1)F 1P003BOE [0,2,0,0,0,0|1,0,1]=4 1778 B11R1.192 CCOc1ncc(c(n1)N)F 1P00DIB7 [0,2,0,0,0,0|0,0,2]=4 1779 B11R2.36 O=c1ccc2c([nH]1)[nH]cc2 1P00382O [0,1,0,1,0,0|2,0,0]=4 1780 B11R2.36 O=c1ccc2c([nH]1)[nH]cn2 1P00C4P2 [0,1,0,1,0,0|2,0,0]=4 1781 B11R2.36 O=c1ccc2c([nH]1)[nH]nc2 1P01IHRV [0,1,0,1,0,0|2,0,0]=4 1782 B7R1.2 Brc1cnc([nH]1)C 1P001TQX [1,0,0,0,1,0|1,1,0]=4 1783 B7R1.2 Brc1cnc([nH]1)I 1P0240J1 [1,0,0,0,1,0|1,1,0]=4 1784 B7R1.2 Brc1ncc([nH]1)Br 1P00390Z [1,0,0,0,1,0|1,1,0]=4 1785 B7R1.2 CC1=CC(=O)N=N1 1P01HFI0 [1,0,0,0,1,0|2,0,0]=4 1786 B7R1.2 Cc1[nH][nH]c(=O)c1 1P0011IO [1,0,0,0,1,0|2,0,0]=4 1787 B7R1.2 Cc1[nH]cc(c1)C 1P0036EO [1,0,0,0,1,0|2,0,0]=4 1788 B7R1.2 Cc1[nH]cc(n1)C 1P0033GF [1,0,0,0,1,0|2,0,0]=4 1789 B7R1.2 Cc1c[nH]c(=O)[nH]1 1P000ITB [1,0,0,0,1,0|1,0,1]=4 1790 B7R1.2 Cc1c[nH]c(=O)s1 1P005LJG [1,0,0,0,1,0|2,0,0]=4 1791 B7R1.2 Cc1c[nH]c(n1)Br 1P028WVE [1,0,0,0,1,0|2,0,0]=4 1792 B7R1.2 Cc1c[nH]c(n1)I 1P00FDDF [1,0,0,0,1,0|2,0,0]=4 1793 B7R1.2 Cc1c[nH]c(n1)N 1P00FB1G [1,0,0,0,1,0|2,0,0]=4 1794 B7R1.2 Cc1c[nH]c(n1)S 1P007G57 [1,0,0,0,1,0|1,1,0]=4 1795 B7R1.2 Cc1cc(=O)[nH]o1 1P00013U [1,0,0,0,1,0|2,0,0]=4 1796 B7R1.2 Cc1cnc([nH]1)Br 1P002NCF [1,0,0,0,1,0|2,0,0]=4 1797 B7R1.2 Cc1cnc([nH]1)Cl 1P01ZYD1 [1,0,0,0,1,0|2,0,0]=4 1798 B7R1.2 Cc1cnc([nH]1)N 1P008U4V [1,0,0,0,1,0|2,0,0]=4 1799 B7R1.2 Cc1csc(=O)[nH]1 1P00CLWY [1,0,0,0,1,0|2,0,0]=4 1800 B7R1.2 Clc1c[nH]c(=O)s1 1P024GK3 [1,0,0,0,1,0|1,1,0]=4 1801 B7R1.2 Clc1cc(=O)[nH]s1 1P00387B [1,0,0,0,1,0|1,1,0]=4 1802 B7R1.2 Clc1ncc([nH]1)Cl 1P0293E4 [1,0,0,0,1,0|1,1,0]=4 1803 B7R1.2 Cn1cc(cn1)F 1P01JWK7 [1,0,0,0,1,0|2,0,0]=4 1804 B7R1.2 Cn1cnc(=O)[nH]1 1P01B1NL [1,0,0,0,1,0|2,0,0]=4 1805 B7R1.2 Fc1cnc(s1)Br 1P0095WU [1,0,0,0,1,0|2,0,0]=4 1806 B7R1.2 Fc1cnc(s1)N 1P005K4Z [1,0,0,0,1,0|2,0,0]=4 1807 B7R1.2 Fc1cnc(s1)N 1P006TUC [1,0,0,0,1,0|2,0,0]=4 1808 B7R1.2 Fc1csc(c1)Br 1P00CA59 [1,0,0,0,1,0|2,0,0]=4 1809 B7R1.2 Fc1nnc([nH]1)Br 1P028DDZ [1,0,0,0,1,0|2,0,0]=4 1810 B7R1.2 Ic1cnc([nH]1)C 1P0036ZU [1,0,0,0,1,0|1,1,0]=4 1811 B7R1.2 Ic1ncc([nH]1)I 1P002G12 [1,0,0,0,1,0|1,1,0]=4 1812 B7R1.2 NC1=NC(=O)NC1 1P01A4K9 [1,0,0,0,1,0|1,0,1]=4 1813 B7R1.2 Nc1[nH][nH]c(=O)c1 1P002VZO [1,0,0,0,1,0|2,0,0]=4 1814 B7R1.2 Nc1[nH][nH]c(=O)n1 1P0001Y3 [1,0,0,0,1,0|2,0,0]=4 1815 B7R1.2 Nc1cc(=O)[nH]o1 1P005GYW [1,0,0,0,1,0|2,0,0]=4 1816 B7R1.2 Nc1n[nH]c(c1)F 1P000HKP [1,0,0,0,1,0|2,0,0]=4 1817 B7R1.2 O=C1C=CC(=O)N1 1P0035L0 [1,0,0,0,1,0|2,0,0]=4 1818 B7R1.2 OC1=CC(=O)NC1 1P00DCWO [1,0,0,0,1,0|1,0,1]=4 1819 B7R1.2 Oc1c[nH]c(n1)C 1P0292BX [1,0,0,0,1,0|2,0,0]=4 1820 B7R1.4 Cc1nc[nH]c1N 1P003L6T [1,0,0,0,1,0|2,0,0]=4 1821 B7R1.4 Cc1ncsc1N 1P00FWA1 [1,0,0,0,1,0|2,0,0]=4 1822 B7R1.4 Cc1ncsc1N 1P01B26U [1,0,0,0,1,0|2,0,0]=4 1823 B7R1.4 Cn1nccc1N 1P000ISJ [1,0,0,0,1,0|2,0,0]=4 1824 B7R1.4 Nc1c[nH]nc1Br 1P009X00 [1,0,0,0,1,0|2,0,0]=4 1825 B7R1.4 Nc1c[nH]nc1C 1P000JZM [1,0,0,0,1,0|2,0,0]=4 1826 B7R1.4 Nc1c[nH]nc1C 1P007B6V [1,0,0,0,1,0|2,0,0]=4 1827 B7R1.4 Nc1c[nH]nc1Cl 1P008UTO [1,0,0,0,1,0|2,0,0]=4 1828 B7R1.4 Nc1c[nH]nc1Cl 1P00EL0C [1,0,0,0,1,0|2,0,0]=4 1829 B7R1.4 Nc1ccsc1Br 1P00IKUH [1,0,0,0,1,0|2,0,0]=4 1830 B7R1.4 Nc1ccsc1C 1P01BRMN [1,0,0,0,1,0|2,0,0]=4 1831 B7R1.4 Nc1ccsc1Cl 1P01AGQV [1,0,0,0,1,0|2,0,0]=4 1832 B7R1.4 Nc1conc1C 1P00CJB5 [1,0,0,0,1,0|2,0,0]=4 1833 B7R1.4 Nc1conc1C 1P01C5S8 [1,0,0,0,1,0|2,0,0]=4 1834 B7R1.4 Nc1csnc1Br 1P028SVW [1,0,0,0,1,0|2,0,0]=4 1835 B7R1.4 Nc1csnc1C 1P01EIGO [1,0,0,0,1,0|2,0,0]=4 1836 B7R1.4 Nc1n[nH]cc1N 1P001VFK [1,0,0,0,1,0|2,0,0]=4 1837 B7R1.4 Nc1n[nH]cc1N 1P00HZ8F [1,0,0,0,1,0|2,0,0]=4 1838 B7R1.4 O=C1OCC=C1N 1P00I73J [1,0,0,0,1,0|1,0,1]=4 1839 B7R1.4 O=c1[nH][nH]cc1N 1P01AMNR [1,0,0,0,1,0|1,0,1]=4 1840 B7R1.15 ClC1=CC(=O)C1=O 1P000YPP [0,0,0,0,2,0|1,1,0]=4 1841 B7R1.15 OC1=CC(=O)C1=O 1P00CI1X [0,0,0,0,2,0|2,0,0]=4 1842 B7R1.15 [O-]C1=CC(=O)C1=O 1P00FBX3 [0,0,0,0,2,0|2,0,0]=4